data_2ndp_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 2ndp _Structure_validation_residue.Date_analyzed 2016-11-04 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.4 ' HA ' ' CE ' ' A' ' 16' ' ' MET . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.438 HG11 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.438 ' H ' HG11 ' A' ' 24' ' ' VAL 0.259 16.3 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.413 ' HA ' HG21 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' B' ' 12' ' ' TYR . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HG2' ' HG1' ' A' ' 86' ' ' THR 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.422 ' HG1' ' HG2' ' A' ' 55' ' ' LYS . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.411 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.422 ' HA ' HG23 ' B' ' 27' ' ' ILE . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.422 HG23 ' HA ' ' B' ' 24' ' ' VAL . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 103.718 -2.697 . . . . 0.0 103.718 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.651 HD22 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t . . . . . 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.442 0 CA-C-O 118.527 -1.152 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m . . . . . 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 115.423 0.929 . . . . 0.0 115.423 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.52 ' H ' ' HG3' ' A' ' 82' ' ' LYS . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.42 HG22 ' H ' ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.42 ' C ' ' H ' ' B' ' 39' ' ' ALA . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 120.573 2.989 . . . . 0.0 120.573 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.42 ' H ' HG22 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.695 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt . . . . . 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HZ3' ' CG ' ' B' ' 26' ' ' ASP . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.43 HD11 ' H ' ' A' ' 34' ' ' LEU . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.505 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.418 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' THR . . . . . 0.424 HG22 ' HB3' ' B' ' 81' ' ' LYS . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' B' ' 60' ' ' THR . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . 0.594 ' H ' HD13 ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 116.016 -1.945 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.488 ' CG2' HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.488 HG21 ' CG2' ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m . . . . . 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt . . . . . 0 N--CA 1.446 -0.675 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.665 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.739 0 CA-C-O 119.061 -0.855 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.8 0 CA-C-O 120.098 -0.279 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HZ3' ' CG ' ' B' ' 26' ' ' ASP . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t . . . . . 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 107.708 -2.157 . . . . 0.0 107.708 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.404 HD11 ' H ' ' A' ' 86' ' ' THR . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.404 ' H ' HD11 ' A' ' 85' ' ' LEU . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.416 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' B' ' 56' ' ' PHE . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . 0.405 ' HB2' ' HB ' ' B' ' 48' ' ' VAL . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.167 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 23.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.413 ' H ' HG12 ' A' ' 27' ' ' ILE . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.429 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HZ1' ' CD ' ' B' ' 15' ' ' GLU . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t . . . . . 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.34 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.584 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.584 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.42 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.429 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.166 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.583 0 N-CA-C 108.352 -1.899 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m . . . . . 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.457 0 CA-C-O 117.962 -1.465 . . . . 0.0 115.011 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.408 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' B' ' 91' ' ' LEU . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t . . . . . 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 117.748 -1.584 . . . . 0.0 113.379 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' H ' ' B' ' 36' ' ' LYS . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG2' ' B' ' 35' ' ' GLN . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 4.6 tp-100 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.42 ' HG ' ' H ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t . . . . . 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.382 0 CA-C-O 117.49 -1.728 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' B' ' 44' ' ' THR . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' THR . . . . . 0.422 ' H ' ' C ' ' B' ' 42' ' ' LEU . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.414 ' CD ' ' HZ1' ' B' ' 55' ' ' LYS . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.414 ' HZ1' ' CD ' ' B' ' 47' ' ' GLU . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 117.85 1.9 . . . . 0.0 117.85 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.452 ' CD ' ' HZ1' ' A' ' 14' ' ' LYS . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.452 ' HZ1' ' CD ' ' A' ' 11' ' ' GLU 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.312 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . 0.408 HD13 ' HB3' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' B' ' 15' ' ' GLU . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.506 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.571 0 CA-C-O 122.807 1.226 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtp . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.77 130.78 37.15 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.624 2.369 . . . . 0.0 108.15 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -96.34 132.67 41.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp -151.18 173.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.926 1 C-N-CA 132.131 4.172 . . . . 0.0 104.121 176.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.4 ' HA ' ' CE ' ' A' ' 16' ' ' MET . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.438 HG11 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.438 ' H ' HG11 ' A' ' 24' ' ' VAL 0.259 16.3 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.413 ' HA ' HG21 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.411 HD23 ' CZ ' ' B' ' 12' ' ' TYR . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HG2' ' HG1' ' A' ' 86' ' ' THR 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t -126.67 146.61 50.13 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 28.2 m -98.88 105.09 17.2 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 105.148 -2.167 . . . . 0.0 105.148 167.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -52.19 151.48 6.97 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -74.62 147.71 36.1 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 122.132 1.797 . . . . 0.0 108.868 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER -144.82 130.8 19.3 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.057 1.343 . . . . 0.0 110.425 -175.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.7 t -48.87 125.8 10.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.278 2.231 . . . . 0.0 107.778 160.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -115.72 141.83 17.17 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-O 115.026 -3.097 . . . . 0.0 117.514 155.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 16.7 tt -134.28 125.0 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 119.885 1.842 . . . . 0.0 108.271 172.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -97.02 119.7 62.9 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 160.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.61 -36.26 18.42 Favored 'Trans proline' 0 N--CA 1.446 -1.315 1 C-N-CA 129.695 6.93 . . . . 0.0 119.465 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -80.65 -21.74 41.14 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -81.46 146.12 30.4 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 116.941 -3.599 . . . . 0.0 113.095 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -77.39 -34.03 54.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.772 1.169 . . . . 0.0 109.703 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -82.65 141.25 32.63 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.008 1.723 . . . . 0.0 111.112 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.6 mttp -97.21 103.94 15.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 128.216 2.606 . . . . 0.0 105.516 176.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.33 93.23 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 103.882 -2.636 . . . . 0.0 103.882 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -92.96 101.65 14.0 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 128.182 2.593 . . . . 0.0 108.963 174.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 69.7 mt -70.15 120.17 76.49 Favored Pre-proline 0 N--CA 1.453 -0.305 0 O-C-N 119.868 -1.77 . . . . 0.0 108.831 -174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.282 84.1 Cg_endo -66.65 -171.05 0.24 Allowed 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.594 3.53 . . . . 0.0 116.695 -177.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.324 . . -83.01 126.73 32.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.65 139.8 11.77 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 167.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.422 ' HG1' ' HG2' ' A' ' 55' ' ' LYS . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.411 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.422 ' HA ' HG23 ' B' ' 27' ' ' ILE . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.422 HG23 ' HA ' ' B' ' 24' ' ' VAL . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m -52.18 112.04 0.73 Allowed 'General case' 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.58 116.6 21.33 Favored Pre-proline 0 N--CA 1.454 -0.237 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -158.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.22 123.73 8.99 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 N-CA-C 108.674 -1.318 . . . . 0.0 108.674 -176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 33.9 ttp85 -77.44 159.63 29.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 112.836 -1.983 . . . . 0.0 111.346 167.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -100.4 139.79 35.58 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 116.954 -3.591 . . . . 0.0 103.817 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -124.73 145.73 15.88 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.302 -2.719 . . . . 0.0 106.302 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 23.7 mm -106.32 93.04 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 1 N-CA-C 98.858 -4.497 . . . . 0.0 98.858 168.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -96.29 141.06 22.59 Favored Pre-proline 0 C--O 1.221 -0.418 0 C-N-CA 127.948 2.499 . . . . 0.0 109.574 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . 0.305 60.5 Cg_endo -56.55 99.05 0.08 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.278 1 C-N-CA 126.19 4.593 . . . . 0.0 115.256 -177.762 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.416 47.2 tptt -150.21 -101.24 0.07 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.366 2.266 . . . . 0.0 112.128 169.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 84.8 m -113.69 174.02 6.13 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.193 1.797 . . . . 0.0 111.584 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -39.89 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 118.39 2.737 . . . . 0.0 118.39 167.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -70.6 149.03 47.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 129.542 3.137 . . . . 0.0 107.208 -175.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -87.03 143.37 27.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 124.349 2.023 . . . . 0.0 109.071 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -119.98 121.09 65.07 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 O-C-N 119.573 -1.954 . . . . 0.0 106.685 -172.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -73.62 137.82 44.46 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.278 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.85 134.99 85.62 Favored Pre-proline 0 N--CA 1.443 -0.815 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 163.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -65.58 130.24 24.49 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.693 1.595 . . . . 0.0 111.409 -160.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.316 . . -83.81 153.49 24.04 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 117.564 -3.21 . . . . 0.0 114.442 169.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.12 122.09 7.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 167.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m -79.85 130.79 35.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -80.61 136.32 36.22 Favored 'General case' 0 N--CA 1.453 -0.31 1 O-C-N 115.786 -4.321 . . . . 0.0 105.383 -178.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--O 1.254 1.307 0 CA-C-N 124.313 3.233 . . . . 0.0 108.313 172.289 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.47 140.92 43.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.911 2.085 . . . . 0.0 107.115 166.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 0.472 77.2 mttt -125.01 153.86 42.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.112 2.133 . . . . 0.0 113.315 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt -165.98 148.37 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 O-C-N 118.223 -2.798 . . . . 0.0 103.718 168.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.651 HD22 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t -143.15 101.25 3.78 Favored 'General case' 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.283 4.5 p -79.17 122.92 26.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.509 1.124 . . . . 0.0 108.197 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.2 pttt -73.1 156.59 89.37 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 120.879 1.672 . . . . 0.0 112.728 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.91 150.58 83.03 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.888 1.725 . . . . 0.0 109.701 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -160.11 169.82 22.52 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 -155.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.289 2.9 t -146.94 134.57 21.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.77 2.224 . . . . 0.0 108.548 -172.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.88 175.15 18.48 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-O 116.504 -2.276 . . . . 0.0 110.729 160.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 pt -97.52 164.56 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 122.722 3.261 . . . . 0.0 110.115 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -80.64 148.93 66.9 Favored Pre-proline 0 N--CA 1.451 -0.406 0 O-C-N 118.808 -2.432 . . . . 0.0 109.173 165.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -83.45 -26.15 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 CA-C-N 122.476 1.92 . . . . 0.0 114.98 -159.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.291 32.7 mtmt -124.5 -10.55 7.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 119.795 1.18 . . . . 0.0 110.371 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 80.3 p -109.82 172.09 7.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 122.05 2.205 . . . . 0.0 108.326 163.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -93.03 -19.36 21.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.112 -1.618 . . . . 0.0 111.504 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -57.32 138.51 54.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -84.69 144.13 28.74 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 118.61 -2.556 . . . . 0.0 107.309 -176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.0 mt -84.0 129.03 38.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 167.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 125.57 41.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 118.855 -1.138 . . . . 0.0 110.46 162.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 mt -89.79 142.37 29.07 Favored Pre-proline 0 N--CA 1.453 -0.303 0 CA-C-O 116.061 -1.923 . . . . 0.0 108.116 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.34 173.72 12.14 Favored 'Trans proline' 0 N--CA 1.439 -1.719 1 C-N-CA 126.244 4.629 . . . . 0.0 113.833 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.7 121.35 27.54 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 100.503 -3.888 . . . . 0.0 100.503 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -111.39 140.39 16.06 Favored Glycine 0 C--N 1.335 0.525 0 O-C-N 119.462 -2.024 . . . . 0.0 111.642 173.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m -96.11 145.25 25.65 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -63.45 134.89 96.02 Favored Pre-proline 0 N--CA 1.44 -0.925 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.96 155.95 38.68 Favored 'Trans proline' 0 N--CA 1.445 -1.372 0 CA-C-N 121.297 1.499 . . . . 0.0 115.493 178.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -73.98 148.93 41.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 126.847 2.059 . . . . 0.0 114.002 160.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t -100.72 154.09 18.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 124.376 2.036 . . . . 0.0 109.068 172.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -136.69 163.34 25.24 Favored Glycine 0 N--CA 1.447 -0.608 1 C-N-CA 131.451 4.358 . . . . 0.0 109.064 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -126.43 136.88 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 127.064 2.146 . . . . 0.0 105.792 170.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -80.68 131.9 59.52 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-O 117.152 -1.404 . . . . 0.0 109.299 170.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -81.79 4.08 7.31 Favored 'Trans proline' 0 N--CA 1.45 -1.045 0 N-CA-C 117.32 2.008 . . . . 0.0 117.32 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -94.58 -57.15 2.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 121.197 -0.939 . . . . 0.0 110.381 -172.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.8 t -137.61 154.43 49.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.084 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . 0.309 13.5 ttpt -48.32 73.65 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 117.727 2.491 . . . . 0.0 117.727 168.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -138.43 147.63 43.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 167.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -98.31 145.88 26.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 119.168 -2.208 . . . . 0.0 107.331 -160.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -126.17 129.2 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 129.084 2.953 . . . . 0.0 105.105 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.303 8.2 tt0 -103.41 116.03 31.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.683 -2.71 . . . . 0.0 103.683 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 8.3 mt -104.36 128.4 27.1 Favored Pre-proline 0 N--CA 1.453 -0.285 1 CA-C-O 111.269 -4.205 . . . . 0.0 107.918 -172.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -80.74 165.79 19.85 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 O-C-N 127.096 3.156 . . . . 0.0 109.045 -169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -140.83 -20.34 0.81 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 110.949 -2.841 . . . . 0.0 115.673 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 148.86 113.99 0.72 Allowed Glycine 0 C--N 1.336 0.573 0 CA-C-N 120.36 1.436 . . . . 0.0 115.423 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m -68.14 121.29 15.86 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -76.9 110.76 11.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.74 3.216 . . . . 0.0 108.726 168.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 pttt . . . . . 0 C--O 1.258 1.505 0 C-N-CA 128.75 2.82 . . . . 0.0 109.676 172.103 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 102.255 -3.239 . . . . 0.0 102.255 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.47 137.7 38.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 167.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -85.29 98.71 10.68 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt -163.82 135.22 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.206 3.441 . . . . 0.0 110.342 -175.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t -162.87 148.83 12.23 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.4 p -117.29 138.46 51.73 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 123.299 1.523 . . . . 0.0 114.58 167.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.431 ' H ' ' HG2' ' A' ' 62' ' ' LYS . 26.6 pttt -70.87 152.17 95.08 Favored Pre-proline 0 N--CA 1.445 -0.686 0 O-C-N 119.549 -1.969 . . . . 0.0 114.933 175.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -75.57 150.76 36.22 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 O-C-N 125.922 2.538 . . . . 0.0 113.015 176.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -150.96 170.47 19.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 130.973 3.709 . . . . 0.0 108.98 -166.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.301 10.1 t -138.61 147.24 42.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 168.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -125.79 -170.39 13.01 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 130.354 3.835 . . . . 0.0 112.311 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 19.1 pt -128.49 163.6 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 117.938 -1.505 . . . . 0.0 110.994 168.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -83.3 154.74 66.58 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 125.427 1.491 . . . . 0.0 114.7 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . 0.264 32.2 Cg_endo -75.34 -22.59 14.07 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 N-CA-C 121.269 3.526 . . . . 0.0 121.269 -175.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.285 81.3 mttt -142.42 13.3 1.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 124.945 2.307 . . . . 0.0 113.81 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.338 46.3 p -134.11 145.57 49.45 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 131.689 3.996 . . . . 0.0 114.394 177.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -73.17 -11.79 60.65 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.981 2.113 . . . . 0.0 115.337 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -66.13 146.11 55.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 126.893 3.235 . . . . 0.0 111.777 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.4 mtpt -75.27 144.38 42.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 111.973 -2.376 . . . . 0.0 106.162 165.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 63.5 mt -92.1 128.29 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 125.81 1.644 . . . . 0.0 106.597 153.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.72 116.68 29.04 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 165.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.6 mp -91.08 121.74 67.46 Favored Pre-proline 0 N--CA 1.451 -0.391 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -76.04 178.66 7.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 1 C-N-CA 125.997 4.465 . . . . 0.0 115.287 -175.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -93.52 121.01 34.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.032 2.933 . . . . 0.0 103.946 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.51 154.58 19.66 Favored Glycine 0 C--N 1.341 0.821 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.52 ' H ' ' HG3' ' A' ' 82' ' ' LYS . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.42 HG22 ' H ' ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.42 ' C ' ' H ' ' B' ' 39' ' ' ALA . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m -82.95 149.44 27.02 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 35.6 pttt -61.63 128.49 90.25 Favored Pre-proline 0 C--O 1.234 0.287 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -172.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.62 -168.44 0.4 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 123.2 2.6 . . . . 0.0 116.862 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 40.2 ttp85 -162.63 151.23 14.62 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 130.644 3.578 . . . . 0.0 108.857 170.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 9.9 t -131.08 141.06 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.131 -2.231 . . . . 0.0 109.127 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.13 -170.79 12.25 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 103.956 -3.657 . . . . 0.0 103.956 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.313 2.6 tt -143.84 137.83 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 128.78 2.832 . . . . 0.0 109.316 -173.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -76.86 127.04 84.9 Favored Pre-proline 0 N--CA 1.446 -0.633 0 C-N-CA 130.938 3.695 . . . . 0.0 108.839 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -81.21 -17.92 8.89 Favored 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 124.335 3.357 . . . . 0.0 116.2 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -96.19 -20.99 18.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 128.907 2.883 . . . . 0.0 111.337 -165.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 7.0 t -162.44 149.79 13.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 8.2 tptt -86.48 79.01 9.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 126.854 3.216 . . . . 0.0 109.607 -154.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.95 135.69 27.78 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 119.32 -2.113 . . . . 0.0 113.103 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mtpt -87.04 131.62 34.05 Favored 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.235 4.214 . . . . 0.0 104.681 171.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.18 118.62 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 103.731 -2.692 . . . . 0.0 103.731 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -87.91 125.05 34.28 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 164.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.2 mt -112.32 129.01 24.75 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 128.454 2.702 . . . . 0.0 105.014 -174.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -89.84 157.21 5.03 Favored 'Trans proline' 0 N--CA 1.441 -1.572 0 C-N-CA 124.238 3.292 . . . . 0.0 111.023 172.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -103.86 -10.39 18.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 128.153 2.581 . . . . 0.0 112.872 159.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.23 150.3 8.32 Favored Glycine 0 N--CA 1.447 -0.613 1 C-N-CA 131.247 4.26 . . . . 0.0 120.573 166.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.42 ' H ' HG22 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t -64.05 91.14 0.07 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.97 116.42 13.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.634 -1.166 . . . . 0.0 113.931 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 ptpt . . . . . 0 C--O 1.246 0.89 0 C-N-CA 130.843 3.657 . . . . 0.0 112.825 171.581 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 N--CA 1.466 0.354 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.45 145.07 27.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 116.313 1.968 . . . . 0.0 116.313 171.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -85.74 155.99 20.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 128.632 2.773 . . . . 0.0 108.014 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt -136.65 138.84 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 126.993 2.117 . . . . 0.0 112.229 -172.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t -158.35 143.31 16.35 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.0 p -102.13 131.44 48.63 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 130.908 3.683 . . . . 0.0 106.512 164.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -83.93 166.5 33.41 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 115.676 -2.107 . . . . 0.0 112.36 -168.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -80.72 146.2 16.57 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 CA-C-N 121.514 1.577 . . . . 0.0 111.747 172.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -141.34 165.91 26.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -170.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.276 7.3 t -142.2 -172.04 3.51 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 127.432 2.293 . . . . 0.0 108.349 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.27 -160.54 26.84 Favored Glycine 0 C--N 1.337 0.637 0 C-N-CA 126.765 2.126 . . . . 0.0 110.947 -169.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.5 mt -136.4 137.05 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.338 3.455 . . . . 0.0 105.52 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -76.29 159.83 79.16 Favored Pre-proline 0 N--CA 1.446 -0.635 0 CA-C-O 123.278 1.513 . . . . 0.0 110.783 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -82.0 -26.7 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.773 1 C-N-CA 125.779 4.319 . . . . 0.0 115.873 -168.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 mttt -128.03 9.73 6.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.05 2.14 . . . . 0.0 109.729 -175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 28.1 p -136.87 152.14 49.9 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 118.995 -2.316 . . . . 0.0 107.509 166.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 ttpt -93.86 6.58 47.96 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 114.892 -2.48 . . . . 0.0 107.949 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -75.28 164.06 26.83 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 123.185 2.72 . . . . 0.0 112.92 169.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -78.98 149.18 32.33 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 112.977 -1.92 . . . . 0.0 106.199 -170.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.9 mt -89.12 131.85 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 164.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -134.29 90.78 2.72 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.538 -2.393 . . . . 0.0 104.538 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 91.7 mt -93.61 120.76 65.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 104.784 -2.302 . . . . 0.0 104.784 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.26 16.3 Cg_endo -80.51 176.8 8.78 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 O-C-N 125.085 2.097 . . . . 0.0 114.996 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.262 . . -77.56 138.53 39.22 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.857 1.663 . . . . 0.0 110.966 164.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.95 159.08 15.1 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m -109.6 140.43 43.43 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -67.43 154.74 92.49 Favored Pre-proline 0 N--CA 1.445 -0.696 0 C-N-CA 124.06 0.944 . . . . 0.0 111.665 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . 0.288 30.2 Cg_endo -82.6 157.2 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 124.509 3.472 . . . . 0.0 113.56 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 36.5 ttp85 -87.2 146.08 26.14 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.316 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.332 11.8 t -139.78 -153.22 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -163.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.44 16.65 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 129.098 3.237 . . . . 0.0 111.003 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 40.6 mm -108.01 128.51 63.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 126.565 1.946 . . . . 0.0 107.009 -174.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -63.21 124.22 83.27 Favored Pre-proline 0 N--CA 1.44 -0.951 0 C-N-CA 126.903 2.081 . . . . 0.0 113.185 170.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -83.84 -15.54 6.98 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-O 112.95 -3.021 . . . . 0.0 114.804 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -95.17 -15.42 23.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 125.932 2.02 . . . . 0.0 112.825 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.4 t -156.66 139.54 15.26 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -67.09 69.3 0.08 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 129.084 2.953 . . . . 0.0 116.882 -165.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -154.78 160.52 41.35 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -168.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -92.52 141.64 28.28 Favored 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 132.87 4.468 . . . . 0.0 103.531 177.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 6.2 mt -110.73 140.13 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 O-C-N 127.918 3.261 . . . . 0.0 102.494 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -127.5 118.17 23.51 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.102 2.961 . . . . 0.0 109.488 155.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -98.7 126.47 38.8 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-O 113.091 -3.337 . . . . 0.0 105.642 168.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.03 160.17 33.56 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 CA-C-N 126.892 3.497 . . . . 0.0 113.367 175.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -89.26 -29.73 19.01 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 130.754 3.622 . . . . 0.0 111.057 171.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.47 162.1 11.21 Favored Glycine 0 N--CA 1.446 -0.695 0 O-C-N 127.116 2.76 . . . . 0.0 108.972 176.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t -73.86 109.13 7.12 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -82.91 108.08 15.98 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 172.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 15.3 pttp . . . . . 0 C--O 1.252 1.2 0 C-N-CA 130.295 3.438 . . . . 0.0 106.777 172.109 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.347 7.2 ttt . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.0 133.53 51.0 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.606 1.562 . . . . 0.0 115.082 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.53 176.57 6.41 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 122.194 2.27 . . . . 0.0 111.259 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt -81.48 149.03 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 166.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HZ3' ' CG ' ' B' ' 26' ' ' ASP . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD11 ' H ' ' A' ' 34' ' ' LEU . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t -127.06 117.91 23.38 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.8 p -88.85 144.22 26.36 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 124.65 1.18 . . . . 0.0 108.964 -169.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 pttt -82.01 156.51 69.6 Favored Pre-proline 0 C--O 1.224 -0.252 0 O-C-N 121.478 -0.764 . . . . 0.0 112.558 -169.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.02 168.7 23.25 Favored 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 121.915 1.743 . . . . 0.0 110.813 171.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -153.9 169.88 22.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 125.368 2.508 . . . . 0.0 107.081 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.365 8.5 t -135.84 137.26 41.33 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.362 -1.744 . . . . 0.0 112.309 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.68 172.08 14.69 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-O 124.744 2.302 . . . . 0.0 107.393 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 mt -129.89 146.53 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 1 O-C-N 115.228 -4.69 . . . . 0.0 105.842 173.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -85.66 166.23 31.03 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 123.449 0.7 . . . . 0.0 111.0 -176.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -86.61 -43.87 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 CA-C-N 120.731 1.297 . . . . 0.0 112.384 -169.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.2 mttp -94.13 -12.47 28.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 117.375 -3.328 . . . . 0.0 114.521 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.8 p -130.83 148.23 52.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 128.699 2.8 . . . . 0.0 107.928 -174.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.302 76.3 mttt -78.79 -1.41 34.67 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.095 -1.628 . . . . 0.0 112.072 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -40.9 127.7 2.63 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.112 3.004 . . . . 0.0 119.112 170.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -70.92 149.51 46.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 128.346 2.659 . . . . 0.0 114.932 -177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.8 mt -126.85 143.27 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 113.122 -1.854 . . . . 0.0 106.169 168.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -113.22 129.05 56.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.696 2.398 . . . . 0.0 105.481 172.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.6 123.92 37.89 Favored Pre-proline 0 N--CA 1.443 -0.824 0 N-CA-C 100.659 -3.83 . . . . 0.0 100.659 173.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.34 160.1 50.49 Favored 'Trans proline' 0 N--CA 1.452 -0.955 1 C-N-CA 127.055 5.17 . . . . 0.0 114.585 173.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.34 130.36 37.03 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 131.243 3.817 . . . . 0.0 110.51 170.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.48 -170.88 14.99 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 130.494 3.902 . . . . 0.0 110.759 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.505 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.418 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' THR . . . . . 0.424 HG22 ' HB3' ' B' ' 81' ' ' LYS . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m -74.84 149.53 39.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -52.18 157.08 2.41 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.4 155.93 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.38 0 C-N-CA 122.183 1.922 . . . . 0.0 109.661 -174.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -80.1 125.01 29.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 151.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.385 12.1 t -136.17 -160.29 1.04 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.101 1.76 . . . . 0.0 111.279 -177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.0 -176.72 19.14 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 125.38 1.467 . . . . 0.0 113.53 -164.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -99.27 134.32 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 101.332 -3.581 . . . . 0.0 101.332 163.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -77.67 139.32 62.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 113.826 -2.988 . . . . 0.0 112.259 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.51 -34.61 0.51 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.154 2.569 . . . . 0.0 117.496 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -83.06 -20.15 35.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 122.724 2.511 . . . . 0.0 116.079 -175.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.306 14.3 t -149.49 155.17 39.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 115.502 -2.189 . . . . 0.0 110.766 168.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -73.35 90.02 1.64 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 129.162 2.985 . . . . 0.0 113.605 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -167.19 168.1 13.75 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 129.604 3.161 . . . . 0.0 115.308 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -96.25 134.46 39.33 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 32.3 mt -75.24 139.51 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.62 2.368 . . . . 0.0 107.407 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -145.75 64.65 1.24 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.707 2.403 . . . . 0.0 114.661 -167.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.13 122.54 41.15 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 117.06 -1.447 . . . . 0.0 109.364 -167.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -78.67 164.27 25.9 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 C-N-CA 122.362 2.041 . . . . 0.0 111.964 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.252 . . -135.03 -2.39 2.57 Favored 'General case' 0 N--CA 1.446 -0.673 2 C-N-CA 134.121 4.968 . . . . 0.0 115.095 -160.391 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.03 167.9 16.27 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 128.725 3.06 . . . . 0.0 111.472 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' B' ' 60' ' ' THR . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . 0.594 ' H ' HD13 ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t -72.24 152.2 42.35 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.299 2.2 t60 -148.23 164.14 34.89 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.435 1.894 . . . . 0.0 112.656 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.486 2.714 . . . . 0.0 108.195 173.492 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 ttm . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 132.33 42.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.996 2.518 . . . . 0.0 109.136 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -80.66 133.63 35.75 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.276 3.031 . . . . 0.0 103.307 172.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt -90.94 130.01 40.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 127.755 2.422 . . . . 0.0 110.611 172.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.3 150.05 35.02 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.0 p -107.54 141.39 39.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.219 3.007 . . . . 0.0 108.854 156.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -74.91 166.05 48.68 Favored Pre-proline 0 N--CA 1.453 -0.311 0 O-C-N 126.544 2.403 . . . . 0.0 109.874 -161.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.268 19.5 Cg_endo -80.74 165.64 19.95 Favored 'Trans proline' 0 N--CA 1.45 -1.059 0 N-CA-C 106.086 -2.313 . . . . 0.0 106.086 174.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.293 69.7 mtm180 -145.45 158.13 43.89 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 129.174 2.99 . . . . 0.0 113.446 -173.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.495 4.4 t -134.83 149.32 50.34 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 118.356 -2.715 . . . . 0.0 111.558 160.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -137.88 -163.0 9.47 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 116.43 -2.317 . . . . 0.0 114.383 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.0 mt -115.52 133.14 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 123.557 1.646 . . . . 0.0 108.883 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -66.0 124.93 89.05 Favored Pre-proline 0 N--CA 1.451 -0.398 0 O-C-N 119.184 -2.197 . . . . 0.0 112.772 158.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.56 -33.41 46.02 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.926 3.751 . . . . 0.0 116.857 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -89.09 -31.81 17.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 119.613 -1.929 . . . . 0.0 110.88 -165.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 65.1 p -139.89 178.16 7.45 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 128.516 2.726 . . . . 0.0 107.742 -174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -101.35 55.76 0.83 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 124.28 1.99 . . . . 0.0 110.0 -168.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -103.14 142.98 33.22 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 175.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -91.36 131.52 36.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 129.09 2.956 . . . . 0.0 111.848 165.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.0 mt -105.29 117.92 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 100.767 -3.79 . . . . 0.0 100.767 -174.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -88.2 108.72 19.43 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 122.644 1.211 . . . . 0.0 111.417 164.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.0 mt -95.72 130.81 30.71 Favored Pre-proline 0 N--CA 1.445 -0.715 0 N-CA-C 101.851 -3.388 . . . . 0.0 101.851 176.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -87.82 161.86 7.61 Favored 'Trans proline' 0 N--CA 1.446 -1.312 0 C-N-CA 122.853 2.369 . . . . 0.0 108.491 -169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -75.48 164.56 26.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.827 1.651 . . . . 0.0 112.393 165.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.59 150.25 17.77 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 -166.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.488 ' CG2' HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.488 HG21 ' CG2' ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m -101.01 139.98 35.95 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 145.48 95.01 Favored Pre-proline 0 CA--C 1.517 -0.315 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.157 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -81.53 169.05 15.79 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 124.621 3.548 . . . . 0.0 112.915 -157.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -101.26 109.75 21.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 125.152 1.381 . . . . 0.0 107.696 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.494 14.0 t -126.45 -175.7 3.46 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.405 -2.18 . . . . 0.0 114.289 -175.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.5 -162.49 22.75 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 128.433 2.92 . . . . 0.0 106.96 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 30.7 mm -85.77 131.5 34.25 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 C-N-CA 128.291 2.636 . . . . 0.0 108.307 176.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -71.17 126.8 91.96 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-O 114.8 -2.524 . . . . 0.0 108.183 169.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -71.21 -34.67 9.7 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 O-C-N 124.565 1.824 . . . . 0.0 113.011 -168.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -86.95 -22.53 25.55 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.877 -3.015 . . . . 0.0 111.202 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.319 2.4 t -152.97 162.85 40.82 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.577 2.751 . . . . 0.0 110.707 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -73.86 78.49 1.62 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 125.14 2.4 . . . . 0.0 113.564 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.335 3.7 pt20 -144.37 178.75 7.71 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.616 -1.928 . . . . 0.0 110.068 172.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -92.27 150.9 20.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 128.294 2.638 . . . . 0.0 115.054 161.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 13.2 mt -69.18 128.1 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 125.701 1.876 . . . . 0.0 109.915 153.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.344 25.7 mt-30 -138.18 65.98 1.45 Allowed 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 56.3 mt -108.53 137.28 19.94 Favored Pre-proline 0 N--CA 1.447 -0.616 0 N-CA-C 104.092 -2.558 . . . . 0.0 104.092 -169.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -66.88 138.5 48.63 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.314 3.343 . . . . 0.0 113.387 175.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.85 -21.41 29.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 121.523 1.965 . . . . 0.0 109.976 167.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 113.55 167.95 16.64 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t -64.25 146.89 53.59 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -156.66 104.76 2.18 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 112.813 -3.47 . . . . 0.0 107.883 167.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 C--O 1.251 1.136 0 C-N-CA 128.943 2.897 . . . . 0.0 109.736 171.425 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.361 6.0 ttt . . . . . 0 N--CA 1.466 0.329 0 CA-C-O 120.496 0.189 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.87 155.81 37.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -74.65 111.64 10.05 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.038 1.735 . . . . 0.0 111.511 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt -69.25 124.41 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 O-C-N 126.463 2.352 . . . . 0.0 105.608 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.665 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t -145.78 144.74 30.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.6 p -113.85 132.46 55.89 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 131.622 3.969 . . . . 0.0 107.847 -173.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -52.5 136.8 42.32 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 129.959 3.303 . . . . 0.0 113.841 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -71.81 157.01 56.15 Favored 'Trans proline' 0 N--CA 1.447 -1.257 0 C-N-CA 122.199 1.933 . . . . 0.0 114.526 166.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.8 mtm105 -142.78 -172.94 3.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 170.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.275 15.0 t -134.7 144.25 47.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.006 2.522 . . . . 0.0 104.963 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.96 -177.43 15.42 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 129.005 3.193 . . . . 0.0 110.969 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.2 mt -135.22 148.38 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 127.847 2.459 . . . . 0.0 106.177 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.09 133.61 78.32 Favored Pre-proline 0 N--CA 1.45 -0.463 0 N-CA-C 103.557 -2.757 . . . . 0.0 103.557 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.08 -9.75 27.2 Favored 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 123.637 2.891 . . . . 0.0 118.393 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tttp -117.79 -53.04 2.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.344 -1.789 . . . . 0.0 113.491 -171.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 61.4 p -100.78 161.29 13.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.467 1.939 . . . . 0.0 109.582 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -78.73 79.4 5.14 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -136.83 152.36 50.18 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 122.953 1.359 . . . . 0.0 113.118 167.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -82.6 157.67 23.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 120.229 -1.544 . . . . 0.0 110.785 172.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.4 mt -123.59 141.25 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 126.84 2.056 . . . . 0.0 106.143 172.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -126.44 125.39 42.06 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 118.597 0.635 . . . . 0.0 112.403 -173.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 12.0 mt -113.27 110.64 50.6 Favored Pre-proline 0 C--O 1.221 -0.435 0 N-CA-C 101.293 -3.595 . . . . 0.0 101.293 -171.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.64 165.4 27.05 Favored 'Trans proline' 0 N--CA 1.441 -1.568 1 C-N-CA 125.925 4.417 . . . . 0.0 112.206 -176.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.02 122.11 24.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 119.793 -1.817 . . . . 0.0 110.366 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -106.63 152.15 16.95 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 120.853 -1.154 . . . . 0.0 112.211 -164.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -88.77 141.12 28.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -51.42 147.42 10.56 Favored Pre-proline 0 N--CA 1.448 -0.533 0 O-C-N 118.361 -2.712 . . . . 0.0 111.16 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -69.72 149.53 67.26 Favored 'Trans proline' 0 N--CA 1.448 -1.168 0 CA-C-O 124.797 1.915 . . . . 0.0 112.334 -178.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -70.48 121.45 17.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.94 -1.482 . . . . 0.0 108.384 166.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 12.9 t -121.99 -137.54 0.31 Allowed 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 116.468 -3.895 . . . . 0.0 112.294 -175.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.38 163.21 20.85 Favored Glycine 0 CA--C 1.527 0.784 1 O-C-N 116.207 -4.058 . . . . 0.0 109.313 -177.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.89 145.02 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 167.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -80.3 129.56 68.98 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 127.847 3.217 . . . . 0.0 107.42 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -84.63 -26.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 0 CA-C-O 118.04 -0.9 . . . . 0.0 110.332 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -77.4 -29.14 52.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 117.881 2.548 . . . . 0.0 117.881 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.3 t -148.18 160.87 42.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.11 2.564 . . . . 0.0 108.469 162.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -78.33 103.04 8.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.853 0.751 . . . . 0.0 109.663 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -165.7 173.5 10.7 Favored 'General case' 0 N--CA 1.448 -0.546 1 C-N-CA 131.71 4.004 . . . . 0.0 107.697 -176.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -101.89 129.43 48.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 125.202 1.564 . . . . 0.0 109.73 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 26.6 mt -70.03 148.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 O-C-N 125.656 1.847 . . . . 0.0 113.632 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -160.58 73.63 0.5 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 104.397 -2.446 . . . . 0.0 104.397 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 91.2 mt -107.75 129.14 24.6 Favored Pre-proline 0 N--CA 1.446 -0.671 0 C-N-CA 128.02 2.528 . . . . 0.0 106.597 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.75 141.93 34.76 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.637 2.891 . . . . 0.0 108.749 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -86.49 -38.57 17.14 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.744 2.418 . . . . 0.0 116.861 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.25 -177.85 19.26 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.856 1.693 . . . . 0.0 112.949 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m -77.18 155.42 32.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.316 58.7 t60 -143.95 154.39 43.26 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.561 2.344 . . . . 0.0 113.379 -178.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.294 18.5 ptmt . . . . . 0 C--O 1.253 1.249 0 CA-C-N 114.29 -1.323 . . . . 0.0 107.852 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.3 ttm . . . . . 0 N--CA 1.467 0.392 1 N-CA-C 100.165 -4.013 . . . . 0.0 100.165 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.09 109.07 18.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -139.52 141.11 37.32 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.119 2.168 . . . . 0.0 111.113 -177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt -92.23 105.45 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 C-N-CA 129.413 3.085 . . . . 0.0 109.035 171.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HZ3' ' CG ' ' B' ' 26' ' ' ASP . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t -135.93 152.66 51.22 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.6 p -116.96 112.16 20.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 113.892 -2.956 . . . . 0.0 108.737 173.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.298 31.6 pttt -35.21 135.18 0.45 Allowed Pre-proline 0 N--CA 1.446 -0.673 0 C-N-CA 130.075 3.35 . . . . 0.0 118.118 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.21 178.43 4.85 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 CA-C-O 124.636 1.848 . . . . 0.0 110.165 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -130.37 -179.05 5.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.033 2.133 . . . . 0.0 111.945 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.8 t -155.87 146.14 21.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 129.98 3.312 . . . . 0.0 112.44 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.79 -162.48 9.83 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 117.829 -2.129 . . . . 0.0 111.817 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.8 pt -140.22 148.82 22.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 131.485 3.914 . . . . 0.0 109.53 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -79.44 153.43 76.37 Favored Pre-proline 0 N--CA 1.446 -0.658 0 C-N-CA 131.062 3.745 . . . . 0.0 105.988 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -89.03 -15.52 2.48 Favored 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 125.236 3.958 . . . . 0.0 115.96 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -89.33 -52.63 4.94 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.311 -3.368 . . . . 0.0 111.283 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.7 p -126.37 152.71 45.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 127.756 3.16 . . . . 0.0 107.16 -165.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -70.27 37.22 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 123.88 1.8 . . . . 0.0 114.504 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -88.83 141.43 28.51 Favored 'General case' 0 N--CA 1.445 -0.721 1 O-C-N 114.639 -5.038 . . . . 0.0 104.197 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -100.73 128.35 46.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 129.284 3.034 . . . . 0.0 103.887 175.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 19.1 mt -92.25 128.4 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 116.79 -1.576 . . . . 0.0 107.744 173.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -103.33 142.01 34.95 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.9 mt -133.55 121.84 16.49 Favored Pre-proline 0 N--CA 1.45 -0.462 0 CA-C-O 112.559 -3.591 . . . . 0.0 109.591 -161.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -92.63 174.58 1.93 Allowed 'Trans proline' 0 N--CA 1.445 -1.349 0 O-C-N 125.518 2.325 . . . . 0.0 110.997 -159.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.21 167.7 16.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 109.957 -3.292 . . . . 0.0 110.445 -171.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.13 127.52 6.5 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 122.206 2.276 . . . . 0.0 107.708 166.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.404 HD11 ' H ' ' A' ' 86' ' ' THR . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.404 ' H ' HD11 ' A' ' 85' ' ' LEU . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.416 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' B' ' 56' ' ' PHE . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . 0.405 ' HB2' ' HB ' ' B' ' 48' ' ' VAL . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m -69.12 152.44 45.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.42 139.01 83.9 Favored Pre-proline 0 N--CA 1.44 -0.935 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -73.71 157.33 48.3 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.823 2.349 . . . . 0.0 115.181 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.367 23.6 mtm105 -92.48 165.67 12.92 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.078 -4.139 . . . . 0.0 108.267 -178.279 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.371 11.7 t -141.68 -161.31 1.2 Allowed 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 124.99 1.432 . . . . 0.0 114.656 -177.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.41 -147.55 19.23 Favored Glycine 0 N--CA 1.441 -0.98 0 C-N-CA 129.304 3.335 . . . . 0.0 109.754 173.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.259 18.8 mm -120.36 134.1 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 128.385 2.674 . . . . 0.0 109.674 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -66.06 128.76 94.03 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.904 2.482 . . . . 0.0 107.841 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.96 -21.53 14.03 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-O 113.387 -2.839 . . . . 0.0 118.737 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.371 86.4 mttt -94.59 -17.09 22.66 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.939 2.649 . . . . 0.0 113.828 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.377 1.4 t -152.18 163.51 39.24 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.798 1.639 . . . . 0.0 109.739 177.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -80.03 92.57 5.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 125.15 2.405 . . . . 0.0 107.765 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.298 12.8 pt20 -155.59 161.09 40.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 108.908 -3.769 . . . . 0.0 108.995 165.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -83.95 166.42 17.84 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.78 1.925 . . . . 0.0 109.199 172.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 76.1 mt -103.82 143.29 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 124.553 2.12 . . . . 0.0 105.617 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -144.23 102.7 3.9 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 108.477 -3.965 . . . . 0.0 103.279 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 12.3 pt -140.07 146.35 46.04 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 120.927 1.694 . . . . 0.0 108.856 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -72.2 154.2 56.8 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 125.243 3.962 . . . . 0.0 113.609 -175.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -113.77 -20.68 11.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.911 2.084 . . . . 0.0 110.051 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.02 -171.05 14.59 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t -160.32 117.21 2.45 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -84.71 116.1 23.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.575 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.31 16.1 pttm . . . . . 0 C--O 1.246 0.869 0 O-C-N 125.885 1.99 . . . . 0.0 113.73 161.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ttt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 116.409 -1.758 . . . . 0.0 106.481 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.251 . . -88.3 -177.58 5.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.341 2.656 . . . . 0.0 109.823 -176.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -89.4 153.35 20.92 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 127.002 2.689 . . . . 0.0 110.025 169.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 23.8 mt -117.06 119.14 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 159.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.413 ' H ' HG12 ' A' ' 27' ' ' ILE . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HZ1' ' CD ' ' B' ' 15' ' ' GLU . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t -143.3 118.65 10.25 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 20.6 p -76.91 157.05 31.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 170.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -55.72 146.91 43.93 Favored Pre-proline 0 N--CA 1.448 -0.527 1 C-N-CA 132.536 4.334 . . . . 0.0 115.439 -174.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -81.57 152.8 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 167.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.284 35.1 mtm105 -121.37 161.27 22.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.5 3.12 . . . . 0.0 110.801 -175.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.34 13.3 t -144.02 101.52 3.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.871 2.869 . . . . 0.0 108.895 166.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.4 -173.05 14.5 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 126.347 1.927 . . . . 0.0 110.138 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.1 pt -106.95 160.39 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 O-C-N 116.701 -3.823 . . . . 0.0 103.688 -160.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -72.25 144.2 86.77 Favored Pre-proline 0 N--CA 1.444 -0.734 0 O-C-N 118.421 -2.674 . . . . 0.0 111.669 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -75.3 -12.54 20.94 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.697 2.931 . . . . 0.0 118.585 -169.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -151.67 -8.25 0.22 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 115.39 -2.243 . . . . 0.0 113.171 -171.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.353 53.5 p -134.14 152.13 51.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.04 2.536 . . . . 0.0 106.461 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -74.2 61.15 0.84 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.317 2.247 . . . . 0.0 115.368 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -133.0 163.8 28.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 128.278 2.631 . . . . 0.0 116.67 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.6 141.51 50.25 Favored 'General case' 0 N--CA 1.45 -0.435 1 C-N-CA 132.778 4.431 . . . . 0.0 106.358 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.9 mt -116.12 157.22 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.326 52.1 mm-40 -109.31 105.93 15.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 124.435 2.064 . . . . 0.0 106.133 159.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.3 mt -90.26 129.5 45.35 Favored Pre-proline 0 N--CA 1.452 -0.342 0 O-C-N 117.285 -3.384 . . . . 0.0 106.188 -173.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.11 165.67 32.09 Favored 'Trans proline' 0 N--CA 1.445 -1.351 0 C-N-CA 122.243 1.962 . . . . 0.0 114.673 -170.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.02 147.51 42.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.42 163.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.11 178.99 16.29 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 170.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.584 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.584 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.42 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.429 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m -102.16 148.14 25.77 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -66.52 127.11 93.19 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-O 114.572 -2.632 . . . . 0.0 106.559 -167.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -69.01 166.19 27.54 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 O-C-N 128.306 3.793 . . . . 0.0 113.207 176.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.333 30.1 mtm180 -98.18 151.53 20.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 130.275 3.43 . . . . 0.0 106.204 171.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -119.67 -143.64 0.36 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.708 173.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.46 170.67 12.04 Favored Glycine 0 CA--C 1.527 0.836 1 C-N-CA 134.155 5.645 . . . . 0.0 110.11 -177.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 41.0 mm -109.63 148.64 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -83.93 131.13 52.47 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-O 116.336 -1.792 . . . . 0.0 108.398 176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -78.23 -21.47 10.49 Favored 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.855 5.036 . . . . 0.0 114.499 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.271 69.9 tttt -74.89 -30.49 61.32 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 129.744 3.218 . . . . 0.0 114.031 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.288 2.0 t -159.98 142.61 13.52 Favored 'General case' 0 N--CA 1.45 -0.441 1 N-CA-C 100.197 -4.001 . . . . 0.0 100.197 175.062 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -68.16 93.2 0.43 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.204 1.401 . . . . 0.0 109.369 -174.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -157.96 154.32 27.6 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.966 0.906 . . . . 0.0 110.498 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -87.02 139.93 30.07 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -171.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 10.4 mt -98.16 152.52 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 C-N-CA 126.629 1.971 . . . . 0.0 107.98 167.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -159.5 125.19 4.24 Favored 'General case' 0 CA--C 1.518 -0.278 1 CA-C-O 128.522 4.01 . . . . 0.0 104.135 173.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . 0.282 5.9 pt -139.7 140.07 23.84 Favored Pre-proline 0 C--O 1.237 0.436 0 C-N-CA 129.645 3.178 . . . . 0.0 114.962 -177.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -72.12 148.11 49.74 Favored 'Trans proline' 0 N--CA 1.447 -1.248 1 C-N-CA 127.415 5.41 . . . . 0.0 113.401 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.28 . . -113.85 -11.98 12.77 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.86 -164.2 12.11 Favored Glycine 0 C--N 1.33 0.222 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m -88.07 85.3 6.94 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -68.39 141.99 55.55 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 127.165 2.186 . . . . 0.0 107.022 148.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 24.4 pttt . . . . . 0 C--O 1.242 0.66 0 C-N-CA 128.331 2.652 . . . . 0.0 108.34 -174.307 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.6 ttp . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 113.893 -2.956 . . . . 0.0 105.929 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.06 150.84 35.28 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 123.319 2.782 . . . . 0.0 106.133 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -154.16 151.91 29.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 130.556 3.542 . . . . 0.0 108.934 174.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt -78.2 120.66 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 O-C-N 118.01 -2.931 . . . . 0.0 107.87 -172.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t -115.16 169.86 8.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 78.9 p -128.68 105.38 8.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 129.083 2.953 . . . . 0.0 105.63 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.282 50.3 pttt -44.33 153.76 0.43 Allowed Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 131.108 3.763 . . . . 0.0 114.683 -165.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.05 163.4 30.86 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 O-C-N 123.333 1.175 . . . . 0.0 113.445 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 41.2 mtm105 -136.09 169.45 17.6 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.444 2.298 . . . . 0.0 111.514 -168.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.254 12.5 t -127.59 156.97 41.43 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 125.681 2.658 . . . . 0.0 109.863 168.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.18 -167.79 11.13 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 105.66 -2.976 . . . . 0.0 105.66 163.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 48.0 pt -125.71 159.74 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 124.34 1.056 . . . . 0.0 108.417 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -72.21 146.28 89.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.653 -2.351 . . . . 0.0 104.653 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -90.58 -7.04 4.16 Favored 'Trans proline' 0 N--CA 1.452 -0.919 1 C-N-CA 127.613 5.542 . . . . 0.0 116.154 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -132.65 9.02 4.24 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.174 -2.829 . . . . 0.0 115.641 -176.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.281 73.7 p -156.19 156.27 33.87 Favored 'General case' 0 N--CA 1.444 -0.769 1 C-N-CA 133.034 4.533 . . . . 0.0 108.112 173.995 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -83.15 45.29 1.01 Allowed 'General case' 0 N--CA 1.451 -0.406 2 O-C-N 115.614 -4.429 . . . . 0.0 115.037 173.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -107.24 133.34 51.96 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 130.214 3.405 . . . . 0.0 112.414 -174.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.329 27.8 tttt -79.29 159.83 27.07 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 125.455 1.722 . . . . 0.0 110.13 -172.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 11.2 mm -133.17 130.18 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 O-C-N 120.419 -1.425 . . . . 0.0 110.228 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.283 7.8 mm100 -95.52 125.43 40.12 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.354 -3.213 . . . . 0.0 106.083 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mt -110.07 140.42 22.34 Favored Pre-proline 0 N--CA 1.446 -0.667 0 O-C-N 128.691 3.744 . . . . 0.0 104.142 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -79.48 158.79 25.68 Favored 'Trans proline' 0 N--CA 1.443 -1.476 0 O-C-N 125.845 2.498 . . . . 0.0 115.868 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.17 164.54 12.98 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 116.682 -2.007 . . . . 0.0 113.689 158.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -126.35 174.83 17.9 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 128.36 3.537 . . . . 0.0 108.352 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m -86.29 144.27 27.48 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.276 64.6 tttt -53.1 100.2 0.22 Allowed Pre-proline 0 N--CA 1.448 -0.557 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.38 165.7 31.65 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 125.292 3.995 . . . . 0.0 113.378 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 25.9 mtm105 -98.47 156.72 16.63 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.261 1.3 t -134.63 131.57 37.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.778 2.431 . . . . 0.0 109.846 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -133.86 -179.51 16.46 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 127.205 2.336 . . . . 0.0 109.862 169.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 17.5 mm -118.69 132.31 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 C-N-CA 127.761 2.424 . . . . 0.0 108.592 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -80.39 127.03 77.42 Favored Pre-proline 0 N--CA 1.45 -0.448 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -78.13 -17.3 13.52 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.252 2.635 . . . . 0.0 112.761 -175.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -112.11 -10.55 13.88 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 126.0 1.72 . . . . 0.0 113.593 -164.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.8 t -149.03 176.6 10.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -93.33 30.74 1.62 Allowed 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.761 3.225 . . . . 0.0 113.981 -156.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -118.5 151.36 37.99 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 129.084 2.954 . . . . 0.0 114.493 -160.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -93.97 145.69 24.47 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.987 1.715 . . . . 0.0 109.816 165.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 68.0 mt -111.99 133.46 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 100.944 -3.725 . . . . 0.0 100.944 177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.01 133.01 55.15 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.345 -1.312 . . . . 0.0 108.525 168.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.61 123.66 31.04 Favored Pre-proline 0 N--CA 1.452 -0.326 0 O-C-N 127.006 2.692 . . . . 0.0 105.893 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -76.28 160.27 36.05 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.597 4.198 . . . . 0.0 112.613 -169.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.347 . . -113.97 -33.3 5.78 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 130.319 3.448 . . . . 0.0 109.943 174.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 120.58 -155.27 16.26 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 157.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t -153.32 92.11 1.57 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -70.28 132.0 45.03 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 128.818 2.847 . . . . 0.0 107.889 177.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 17.1 mttp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 128.121 2.569 . . . . 0.0 110.265 169.84 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.6 ttm . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.19 112.08 12.28 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.91 1.684 . . . . 0.0 107.012 174.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -117.44 130.12 56.27 Favored 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 118.84 -2.412 . . . . 0.0 109.903 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp -80.97 141.99 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 131.641 3.977 . . . . 0.0 104.336 -177.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t -136.0 124.34 23.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.0 p -88.5 118.5 28.19 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 125.168 2.413 . . . . 0.0 106.153 163.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -50.33 162.89 0.48 Allowed Pre-proline 0 N--CA 1.442 -0.855 1 O-C-N 115.225 -4.672 . . . . 0.0 115.058 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -75.99 149.71 33.12 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 CA-C-O 117.379 -1.175 . . . . 0.0 109.54 163.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -142.34 176.51 8.94 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 126.631 1.973 . . . . 0.0 110.055 173.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.305 7.9 t -135.29 125.22 25.72 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 128.613 2.765 . . . . 0.0 110.733 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.95 -168.7 16.54 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 106.493 -2.643 . . . . 0.0 106.493 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 pt -132.41 148.03 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 1 C-N-CA 133.792 4.837 . . . . 0.0 107.227 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -57.46 133.28 81.8 Favored Pre-proline 0 N--CA 1.445 -0.675 0 O-C-N 127.109 2.756 . . . . 0.0 115.516 158.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.64 -20.73 9.1 Favored 'Trans proline' 0 N--CA 1.446 -1.277 0 O-C-N 116.383 -2.482 . . . . 0.0 115.575 -172.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -102.06 -17.01 16.25 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 121.854 2.116 . . . . 0.0 116.175 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 51.1 p -134.63 159.33 41.56 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.088 2.155 . . . . 0.0 109.528 176.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -86.04 103.92 15.17 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.936 -2.246 . . . . 0.0 104.936 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -158.2 128.29 6.06 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 103.547 -2.76 . . . . 0.0 103.547 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -84.5 133.42 34.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 23.0 mm -124.74 120.8 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 126.837 2.055 . . . . 0.0 105.912 -177.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.314 44.3 mm-40 -85.93 141.9 29.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.392 -2.693 . . . . 0.0 111.428 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 63.3 mt -106.41 115.62 60.53 Favored Pre-proline 0 N--CA 1.439 -0.986 0 C-N-CA 126.516 1.926 . . . . 0.0 107.851 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.83 162.7 32.15 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.376 3.384 . . . . 0.0 112.065 -168.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.53 132.11 45.02 Favored 'General case' 0 N--CA 1.451 -0.389 1 O-C-N 129.6 4.313 . . . . 0.0 108.252 174.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.48 157.3 20.83 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 127.393 2.425 . . . . 0.0 115.011 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.408 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -80.14 135.55 36.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.402 12.1 tttt -41.44 119.31 1.89 Allowed Pre-proline 0 CA--C 1.513 -0.459 0 C-N-CA 128.671 2.788 . . . . 0.0 117.614 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -78.64 175.84 10.56 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 124.841 3.694 . . . . 0.0 110.812 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -100.2 159.89 14.76 Favored 'General case' 0 C--N 1.328 -0.347 1 C-N-CA 132.022 4.129 . . . . 0.0 107.717 159.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -145.59 128.24 16.17 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 -167.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -131.59 -173.04 13.23 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 119.656 -1.259 . . . . 0.0 112.764 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -119.54 142.58 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.185 2.194 . . . . 0.0 112.249 173.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -74.46 136.46 74.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 103.498 -2.779 . . . . 0.0 103.498 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -83.86 3.05 7.9 Favored 'Trans proline' 0 N--CA 1.447 -1.224 1 C-N-CA 125.543 4.162 . . . . 0.0 111.472 174.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 27.7 tptt -122.52 -16.04 7.39 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 121.376 1.898 . . . . 0.0 113.158 -168.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 3.9 t -160.83 160.37 31.05 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.591 3.557 . . . . 0.0 107.93 -167.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -89.94 49.19 1.68 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.147 2.179 . . . . 0.0 108.277 -174.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -113.92 156.98 23.02 Favored 'General case' 0 N--CA 1.451 -0.421 1 C-N-CA 133.993 4.917 . . . . 0.0 109.427 169.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -80.44 171.75 14.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 129.101 2.96 . . . . 0.0 107.653 168.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 96.6 mt -129.93 129.14 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 101.677 -3.453 . . . . 0.0 101.677 159.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -103.42 135.99 44.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 104.869 -2.271 . . . . 0.0 104.869 179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.19 98.08 42.24 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 128.242 2.617 . . . . 0.0 112.907 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.42 164.1 36.63 Favored 'Trans proline' 0 N--CA 1.451 -0.974 1 C-N-CA 126.276 4.651 . . . . 0.0 111.433 -170.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -114.35 -48.05 2.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -178.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 133.57 -147.33 18.99 Favored Glycine 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' B' ' 91' ' ' LEU . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . 0.434 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t -155.15 94.23 1.6 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -66.13 136.64 56.23 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.92 1.288 . . . . 0.0 111.74 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt . . . . . 0 C--O 1.258 1.535 0 C-N-CA 129.494 3.118 . . . . 0.0 107.202 169.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 121.668 0.747 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.24 79.65 7.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 125.941 2.781 . . . . 0.0 110.958 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -84.26 149.72 25.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.377 -2.647 . . . . 0.0 105.848 172.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm -84.83 130.55 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 129.212 3.005 . . . . 0.0 110.093 169.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t -145.4 175.51 10.26 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.0 p -123.97 173.74 8.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 127.221 2.208 . . . . 0.0 110.642 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.3 pttt -84.33 158.67 60.4 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 114.569 -2.634 . . . . 0.0 112.937 167.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.0 149.85 53.61 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 CA-C-N 124.281 2.564 . . . . 0.0 112.283 171.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.315 34.8 mtm105 -137.89 169.15 18.28 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.321 3.048 . . . . 0.0 110.564 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.345 2.8 t -151.76 148.32 27.74 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.543 1.937 . . . . 0.0 105.94 -178.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.31 -177.2 15.71 Favored Glycine 0 N--CA 1.447 -0.577 1 C-N-CA 132.409 4.814 . . . . 0.0 108.32 -175.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.267 1.5 pp -120.36 152.99 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 C-N-CA 126.125 1.77 . . . . 0.0 107.044 173.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.3 133.16 39.2 Favored Pre-proline 0 N--CA 1.439 -1.025 0 C-N-CA 130.256 3.423 . . . . 0.0 102.018 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.78 -17.86 5.82 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 N-CA-C 117.834 2.206 . . . . 0.0 117.834 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -93.02 -27.31 17.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.092 1.757 . . . . 0.0 112.523 -171.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 69.9 p -146.65 173.96 11.88 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 126.66 1.984 . . . . 0.0 107.823 176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -87.19 72.22 9.96 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.979 0.912 . . . . 0.0 108.621 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -126.99 166.45 17.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 131.325 3.85 . . . . 0.0 110.134 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -102.92 160.21 14.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.89 2.476 . . . . 0.0 113.12 164.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.6 mm -115.57 136.27 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 O-C-N 127.344 2.903 . . . . 0.0 103.526 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -98.19 134.81 40.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.612 . . . . 0.0 108.612 170.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.4 mt -125.31 101.12 31.64 Favored Pre-proline 0 N--CA 1.448 -0.558 0 N-CA-C 102.993 -2.965 . . . . 0.0 102.993 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -82.82 170.63 12.47 Favored 'Trans proline' 0 N--CA 1.451 -0.995 1 C-N-CA 127.333 5.356 . . . . 0.0 108.703 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -102.94 147.27 27.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 169.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.27 137.22 12.84 Favored Glycine 0 CA--C 1.528 0.85 1 C-N-CA 134.454 5.788 . . . . 0.0 113.379 170.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' H ' ' B' ' 36' ' ' LYS . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG2' ' B' ' 35' ' ' GLN . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m -98.23 137.01 37.61 Favored 'General case' 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -62.47 129.7 92.78 Favored Pre-proline 0 N--CA 1.449 -0.481 0 C-N-CA 129.357 3.063 . . . . 0.0 107.683 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -84.48 177.7 5.54 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 O-C-N 123.007 1.004 . . . . 0.0 114.512 -178.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -124.26 166.16 16.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 128.856 2.862 . . . . 0.0 107.009 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.313 2.7 t -140.66 162.91 34.26 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.74 172.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.88 170.91 22.63 Favored Glycine 0 N--CA 1.443 -0.866 0 O-C-N 128.453 3.596 . . . . 0.0 106.946 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.92 146.92 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 C-N-CA 130.291 3.437 . . . . 0.0 105.46 165.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -82.86 133.78 48.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 O-C-N 125.261 1.601 . . . . 0.0 107.032 177.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -84.23 -18.96 4.82 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 CA-C-N 123.757 2.377 . . . . 0.0 112.63 -176.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -87.19 -29.57 21.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.074 2.734 . . . . 0.0 108.502 -171.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.5 t -136.61 160.63 38.24 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.345 2.258 . . . . 0.0 111.408 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -79.26 78.36 5.75 Favored 'General case' 0 C--O 1.237 0.416 2 C-N-CA 131.878 4.071 . . . . 0.0 106.714 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -138.61 167.14 22.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.346 3.458 . . . . 0.0 111.728 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -114.25 159.5 20.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.09 -2.256 . . . . 0.0 110.353 -169.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -136.77 133.41 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.618 3.567 . . . . 0.0 101.496 -167.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.25 67.4 mm-40 -106.94 137.57 44.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 169.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 85.1 mt -127.8 109.65 20.41 Favored Pre-proline 0 N--CA 1.446 -0.627 0 O-C-N 125.945 2.028 . . . . 0.0 108.337 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.38 146.99 25.24 Favored 'Trans proline' 0 N--CA 1.439 -1.693 0 C-N-CA 122.774 2.316 . . . . 0.0 106.959 177.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.287 . . -103.68 -38.86 6.92 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 142.72 -174.96 23.27 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 170.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . 0.442 ' CG ' ' HZ2' ' B' ' 99' ' ' LYS . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.2 136.19 3.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -65.24 125.65 25.68 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.518 3.056 . . . . 0.0 112.076 169.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . 0.442 ' HZ2' ' CG ' ' B' ' 93' ' ' ASP . 10.2 ptpp? . . . . . 0 C--O 1.25 1.106 0 O-C-N 116.378 -3.951 . . . . 0.0 104.981 -175.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 ttp . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 117.3 -1.333 . . . . 0.0 111.575 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.43 146.47 26.95 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.46 1.027 . . . . 0.0 110.749 174.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -90.85 99.13 12.22 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.492 2.995 . . . . 0.0 104.375 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm -101.81 130.92 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 4.6 tp-100 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.42 ' HG ' ' H ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t -150.0 139.28 21.31 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 69.1 p -97.08 141.24 30.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 126.848 2.059 . . . . 0.0 108.175 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -68.49 155.31 93.0 Favored Pre-proline 0 C--O 1.225 -0.225 0 CA-C-N 124.047 3.112 . . . . 0.0 112.107 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.01 159.23 30.66 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 116.916 -1.589 . . . . 0.0 111.547 174.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.25 40.7 mtm105 -130.2 163.98 25.51 Favored 'General case' 0 N--CA 1.451 -0.407 1 O-C-N 132.179 5.924 . . . . 0.0 107.116 -177.54 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -149.96 145.77 26.65 Favored 'General case' 0 N--CA 1.449 -0.518 2 C-N-CA 134.408 5.083 . . . . 0.0 116.07 168.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.49 166.85 25.72 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 104.63 -3.388 . . . . 0.0 104.63 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.2 pt -104.6 155.69 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 126.909 2.084 . . . . 0.0 110.962 167.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.88 132.0 37.74 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 103.111 -2.922 . . . . 0.0 103.111 -175.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.86 -20.55 22.29 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 CA-C-O 114.809 -2.246 . . . . 0.0 111.907 -174.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.22 -29.06 14.24 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 129.413 3.085 . . . . 0.0 112.965 -171.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.9 p -148.36 157.67 43.63 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.433 3.493 . . . . 0.0 113.347 -165.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -72.6 69.89 0.9 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 124.712 2.196 . . . . 0.0 113.307 172.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -133.08 108.87 9.12 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 119.144 -2.222 . . . . 0.0 107.96 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -92.05 133.47 35.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 26.2 mm -110.36 132.44 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 O-C-N 119.478 -2.014 . . . . 0.0 106.802 -172.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -105.52 130.34 53.61 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 130.24 3.416 . . . . 0.0 105.292 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 5.4 mt -116.8 99.09 52.7 Favored Pre-proline 0 N--CA 1.451 -0.405 0 C-N-CA 127.135 2.174 . . . . 0.0 108.045 170.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -84.18 172.36 9.63 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-N 120.354 1.162 . . . . 0.0 114.061 -174.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.99 140.1 45.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 122.34 1.067 . . . . 0.0 113.473 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.68 142.04 16.27 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 129.615 3.483 . . . . 0.0 110.148 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' B' ' 44' ' ' THR . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' THR . . . . . 0.422 ' H ' ' C ' ' B' ' 42' ' ' LEU . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.414 ' CD ' ' HZ1' ' B' ' 55' ' ' LYS . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.414 ' HZ1' ' CD ' ' B' ' 47' ' ' GLU . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m -107.61 136.95 46.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -63.26 125.12 86.38 Favored Pre-proline 0 CA--C 1.514 -0.409 0 C-N-CA 129.864 3.266 . . . . 0.0 111.831 -176.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -61.33 164.2 15.65 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 O-C-N 125.861 2.506 . . . . 0.0 115.461 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -97.25 163.08 13.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 128.073 2.549 . . . . 0.0 110.857 156.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.388 12.9 t -149.14 138.14 21.35 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.068 3.347 . . . . 0.0 110.299 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.19 -176.66 14.47 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 117.005 -1.997 . . . . 0.0 113.731 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.3 mm -112.48 147.01 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.786 3.293 . . . . 0.0 107.294 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -72.96 133.17 82.12 Favored Pre-proline 0 N--CA 1.445 -0.684 0 C-N-CA 129.182 2.993 . . . . 0.0 109.318 169.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.73 -42.02 1.92 Allowed 'Trans proline' 0 N--CA 1.439 -1.7 0 O-C-N 124.825 1.961 . . . . 0.0 115.435 177.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -79.74 -18.77 50.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.873 3.269 . . . . 0.0 115.481 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 2.5 t -157.24 156.74 33.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.408 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -67.42 101.28 0.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 125.698 1.874 . . . . 0.0 107.126 170.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -172.03 138.72 1.04 Allowed 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.208 2.603 . . . . 0.0 113.497 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -92.41 138.91 31.11 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.551 1.167 . . . . 0.0 108.551 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.8 mt -94.81 145.53 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-O 113.601 -3.095 . . . . 0.0 108.818 166.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -119.76 126.96 52.3 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.783 2.552 . . . . 0.0 105.331 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.0 mt -127.68 121.5 22.18 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-N 121.868 2.122 . . . . 0.0 108.903 -174.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -84.0 172.91 9.46 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 CA-C-N 123.937 2.442 . . . . 0.0 115.553 -172.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -134.75 14.59 3.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 118.569 2.803 . . . . 0.0 118.569 178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 98.6 -176.23 29.77 Favored Glycine 0 CA--C 1.525 0.71 0 O-C-N 119.045 -2.284 . . . . 0.0 117.85 167.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t -169.21 113.67 0.55 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -81.94 116.94 21.8 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 124.857 2.265 . . . . 0.0 108.199 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.331 0.1 OUTLIER . . . . . 0 C--O 1.247 0.951 0 CA-C-O 114.92 -2.467 . . . . 0.0 110.463 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 mtt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 125.82 2.724 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.42 163.06 12.54 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 125.303 2.477 . . . . 0.0 112.079 175.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -109.24 103.74 12.76 Favored 'General case' 0 N--CA 1.453 -0.29 1 O-C-N 115.629 -4.419 . . . . 0.0 102.39 169.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt -95.14 127.22 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.452 ' CD ' ' HZ1' ' A' ' 14' ' ' LYS . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.452 ' HZ1' ' CD ' ' A' ' 11' ' ' GLU 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t -142.72 134.5 26.81 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.2 p -107.53 128.17 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 127.472 2.309 . . . . 0.0 106.588 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.6 pttt -72.82 163.27 69.48 Favored Pre-proline 0 N--CA 1.45 -0.465 0 C-N-CA 125.854 1.662 . . . . 0.0 112.948 168.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.39 170.82 16.42 Favored 'Trans proline' 0 N--CA 1.442 -1.523 1 C-N-CA 125.618 4.212 . . . . 0.0 118.183 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 59.6 mtm180 -153.39 169.68 22.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.673 2.789 . . . . 0.0 113.632 -170.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.281 3.6 t -138.91 138.44 37.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 125.041 1.463 . . . . 0.0 110.788 163.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.69 160.54 13.09 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 106.044 -2.822 . . . . 0.0 106.044 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -97.48 159.63 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 124.924 2.297 . . . . 0.0 108.666 170.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -77.4 133.32 67.9 Favored Pre-proline 0 N--CA 1.443 -0.823 1 C-N-CA 136.583 5.953 . . . . 0.0 107.066 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -84.14 -18.34 5.21 Favored 'Trans proline' 0 N--CA 1.447 -1.264 0 C-N-CA 125.294 3.996 . . . . 0.0 117.599 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -96.8 -34.0 11.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.644 1.578 . . . . 0.0 110.003 -173.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.5 p -135.41 175.56 9.48 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 122.062 2.21 . . . . 0.0 107.862 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -76.22 68.94 2.7 Favored 'General case' 0 N--CA 1.451 -0.423 1 O-C-N 114.542 -5.098 . . . . 0.0 111.812 159.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -128.36 -174.78 3.32 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 117.529 -3.232 . . . . 0.0 107.78 170.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -149.49 156.91 42.75 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.083 -172.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.96 128.4 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 116.757 -1.592 . . . . 0.0 107.781 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -85.2 123.88 31.21 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.299 -2.286 . . . . 0.0 105.037 169.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 85.4 mt -102.72 122.17 46.91 Favored Pre-proline 0 N--CA 1.447 -0.596 0 N-CA-C 103.313 -2.847 . . . . 0.0 103.313 -174.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.44 165.26 20.92 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-O 125.256 2.107 . . . . 0.0 111.439 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.58 150.86 42.74 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 109.113 -3.676 . . . . 0.0 110.337 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -113.5 161.92 12.54 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 129.283 3.325 . . . . 0.0 106.161 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . 0.408 HD13 ' HB3' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m -98.06 153.98 18.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -60.24 123.15 71.65 Favored Pre-proline 0 N--CA 1.447 -0.577 0 C-N-CA 126.097 1.759 . . . . 0.0 109.145 176.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.74 159.88 49.58 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 CA-C-N 123.542 2.301 . . . . 0.0 115.287 168.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -103.83 166.28 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.108 3.763 . . . . 0.0 115.26 172.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.259 9.2 t -141.81 143.08 33.24 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 125.457 2.551 . . . . 0.0 107.918 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.51 -176.69 15.34 Favored Glycine 0 CA--C 1.527 0.838 0 CA-C-N 110.835 -2.893 . . . . 0.0 112.378 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.2 mm -129.06 132.67 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.53 131.6 94.88 Favored Pre-proline 0 N--CA 1.449 -0.517 0 O-C-N 116.908 -3.62 . . . . 0.0 114.761 156.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -82.96 -7.84 11.15 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 N-CA-C 121.341 3.554 . . . . 0.0 121.341 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -92.39 -23.46 19.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 116.782 -1.58 . . . . 0.0 112.321 -170.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.9 t -149.72 141.36 23.52 Favored 'General case' 0 N--CA 1.444 -0.743 1 N-CA-C 98.683 -4.562 . . . . 0.0 98.683 164.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -77.32 85.14 3.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pt20 -131.9 142.81 49.77 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 126.5 1.92 . . . . 0.0 110.445 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -85.17 125.82 33.14 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.36 2.264 . . . . 0.0 111.235 -163.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mt -84.04 157.69 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 125.929 1.692 . . . . 0.0 106.466 171.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -122.39 130.03 52.69 Favored 'General case' 0 N--CA 1.445 -0.687 1 N-CA-C 99.021 -4.437 . . . . 0.0 99.021 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.7 mt -135.68 123.05 14.82 Favored Pre-proline 0 N--CA 1.445 -0.711 1 O-C-N 129.9 4.5 . . . . 0.0 104.692 -169.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.86 167.0 28.42 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.075 1.183 . . . . 0.0 113.403 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -142.33 -19.36 0.7 Allowed 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.827 3.251 . . . . 0.0 113.29 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.75 -159.63 18.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 158.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t -131.66 107.01 8.52 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.0 t60 -87.3 140.93 29.04 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 126.285 2.945 . . . . 0.0 104.079 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.374 0 O-C-N 116.753 -3.717 . . . . 0.0 112.092 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ttt . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 111.909 -3.9 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.77 84.27 0.89 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 101.483 -3.525 . . . . 0.0 101.483 169.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -83.75 65.62 8.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.427 1.891 . . . . 0.0 105.936 171.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt -129.51 131.09 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 -161.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' B' ' 15' ' ' GLU . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t -153.06 140.95 20.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.5 p -122.37 138.73 54.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 129.598 3.159 . . . . 0.0 109.115 166.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -88.81 154.41 50.19 Favored Pre-proline 0 N--CA 1.45 -0.431 0 C-N-CA 127.591 2.356 . . . . 0.0 111.938 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.323 50.9 Cg_endo -66.93 164.71 28.71 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 N-CA-C 119.766 2.948 . . . . 0.0 119.766 -170.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -130.17 136.28 49.08 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 127.674 2.39 . . . . 0.0 110.144 175.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.2 t -141.3 -174.23 3.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.46 -147.39 16.56 Favored Glycine 0 C--N 1.337 0.597 0 O-C-N 118.855 -2.403 . . . . 0.0 111.629 178.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.2 pt -132.27 140.33 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.54 128.69 88.61 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 114.836 -2.507 . . . . 0.0 109.799 163.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -74.16 -28.06 11.14 Favored 'Trans proline' 0 N--CA 1.444 -1.408 0 O-C-N 127.191 3.206 . . . . 0.0 116.79 -175.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -94.0 -30.46 14.71 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.222 3.009 . . . . 0.0 108.086 -166.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.7 p -143.28 159.71 41.84 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 125.596 1.81 . . . . 0.0 109.186 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -69.84 91.75 0.66 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.349 1.86 . . . . 0.0 112.964 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -159.41 131.87 6.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.78 2.832 . . . . 0.0 107.625 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -43.79 141.63 1.51 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 157.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.3 mt -105.15 132.65 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 100.873 -3.751 . . . . 0.0 100.873 161.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -147.98 77.58 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 -178.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.4 mt -92.96 127.57 46.95 Favored Pre-proline 0 CA--C 1.513 -0.453 0 N-CA-C 102.915 -2.995 . . . . 0.0 102.915 172.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -87.23 172.02 6.28 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 O-C-N 125.414 2.27 . . . . 0.0 109.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -53.69 151.15 6.41 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 128.516 2.726 . . . . 0.0 111.304 171.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -139.78 124.47 2.72 Favored Glycine 0 C--N 1.337 0.593 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 40' ' ' LYS . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 6.6 m -89.55 137.34 32.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -44.05 125.06 4.31 Favored Pre-proline 0 N--CA 1.445 -0.683 0 C-N-CA 128.938 2.895 . . . . 0.0 110.757 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.48 141.16 83.04 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 123.667 2.911 . . . . 0.0 116.964 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -85.69 167.32 15.4 Favored 'General case' 0 N--CA 1.451 -0.383 1 O-C-N 129.411 4.195 . . . . 0.0 105.538 166.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.1 t -132.5 137.48 47.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.16 1.933 . . . . 0.0 113.972 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.49 -171.21 15.47 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 113.119 -1.855 . . . . 0.0 112.179 169.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.4 mm -110.41 137.12 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 102.509 -3.145 . . . . 0.0 102.509 161.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -50.49 129.72 25.94 Favored Pre-proline 0 N--CA 1.444 -0.774 0 C-N-CA 131.218 3.807 . . . . 0.0 112.167 167.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.8 -34.13 50.93 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 124.931 3.754 . . . . 0.0 121.061 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -90.71 -21.99 21.33 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.126 2.87 . . . . 0.0 115.553 -167.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 9.2 t -157.71 157.13 32.9 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 118.881 -2.387 . . . . 0.0 107.218 -170.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -82.61 83.37 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 117.738 -3.101 . . . . 0.0 110.285 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -138.76 156.48 47.33 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.991 2.516 . . . . 0.0 109.313 -174.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -81.67 143.25 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 114.875 -2.488 . . . . 0.0 111.538 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 2.1 mt -98.88 137.42 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 127.188 2.195 . . . . 0.0 106.753 165.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -98.99 101.19 12.49 Favored 'General case' 0 C--N 1.324 -0.538 1 C-N-CA 133.07 4.548 . . . . 0.0 109.336 154.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 25.9 mt -100.88 122.92 47.28 Favored Pre-proline 0 CA--C 1.515 -0.389 0 C-N-CA 127.349 2.26 . . . . 0.0 106.323 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -70.27 151.95 66.4 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.799 2.333 . . . . 0.0 112.826 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -121.62 -5.13 9.23 Favored 'General case' 0 CA--C 1.513 -0.452 0 O-C-N 126.342 2.277 . . . . 0.0 111.838 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.18 -165.07 25.01 Favored Glycine 0 C--N 1.341 0.841 0 C-N-CA 126.973 2.225 . . . . 0.0 113.584 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p -137.77 148.76 45.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 28.0 t60 -76.77 100.81 5.59 Favored 'General case' 0 N--CA 1.44 -0.959 0 O-C-N 124.898 1.374 . . . . 0.0 110.952 -170.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 82.5 mttt . . . . . 0 C--O 1.251 1.145 0 O-C-N 119.356 -2.09 . . . . 0.0 111.139 -170.737 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.648 HG13 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.648 ' H ' HG13 ' A' ' 24' ' ' VAL 0.259 54.7 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.456 ' HA ' HG22 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' B' ' 34' ' ' LEU . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.462 HG23 ' HA ' ' B' ' 82' ' ' LYS . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.494 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 12' ' ' TYR . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' A' ' 34' ' ' LEU . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.432 ' HA ' HG22 ' B' ' 44' ' ' THR . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' THR . . . . . 0.432 HG22 ' HA ' ' B' ' 41' ' ' GLU . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.462 ' HA ' HG23 ' A' ' 92' ' ' THR . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 103.718 -2.697 . . . . 0.0 103.718 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 27' ' ' ILE . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD21 HG22 ' B' ' 31' ' ' VAL . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' HD2' ' B' ' 3' ' ' LYS . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 45' ' ' THR . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 44' ' ' THR 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' B' ' 5' ' ' LYS . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 53' ' ' ILE . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t . . . . . 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.442 0 CA-C-O 118.527 -1.152 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' LYS . . . . . 0.51 ' HD2' ' HG2' ' A' ' 41' ' ' GLU . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.426 ' HG3' HD22 ' A' ' 50' ' ' LEU . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.408 ' O ' HG22 ' B' ' 32' ' ' THR . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.742 HG22 HD21 ' A' ' 34' ' ' LEU . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' THR . . . . . 0.408 HG22 ' O ' ' B' ' 28' ' ' ARG . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m . . . . . 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 115.423 0.929 . . . . 0.0 115.423 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.638 HG11 HG21 ' B' ' 30' ' ' VAL . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.454 HD22 HD12 ' A' ' 83' ' ' ILE . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.447 HD22 ' HG3' ' B' ' 5' ' ' LYS . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 HD22 ' A' ' 42' ' ' LEU . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.501 HG11 HD12 ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 93' ' ' ASP . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 91' ' ' LEU . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HG ' HG23 ' A' ' 90' ' ' ILE . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 89' ' ' LYS . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.447 ' HG3' HD22 ' A' ' 50' ' ' LEU . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.517 HD13 HG21 ' B' ' 22' ' ' ILE . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.638 HG21 HG11 ' A' ' 30' ' ' VAL . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' THR . . . . . 0.453 ' CG2' HG23 ' B' ' 60' ' ' THR 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' THR . . . . . 0.453 HG23 ' CG2' ' B' ' 45' ' ' THR . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 120.573 2.989 . . . . 0.0 120.573 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.438 HD12 ' N ' ' A' ' 27' ' ' ILE . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.489 ' N ' HD12 ' B' ' 22' ' ' ILE . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.71 HD21 HG23 ' B' ' 48' ' ' VAL . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.71 HG23 HD21 ' B' ' 42' ' ' LEU . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.695 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt . . . . . 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.418 ' HB3' HD11 ' B' ' 22' ' ' ILE . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 27' ' ' ILE . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.571 HG21 ' HD1' ' B' ' 12' ' ' TYR . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.509 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.571 ' HD1' HG21 ' A' ' 37' ' ' VAL . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 29' ' ' LEU . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 34' ' ' LEU . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.602 HD21 ' HD2' ' B' ' 81' ' ' LYS 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 81' ' ' LYS . . . . . 0.602 ' HD2' HD21 ' B' ' 58' ' ' LEU . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.448 ' H ' HG13 ' B' ' 83' ' ' ILE . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.631 HD12 ' H ' ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 116.016 -1.945 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.907 HG23 HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.537 ' O ' HG22 ' A' ' 92' ' ' THR . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.907 HG21 HG23 ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m . . . . . 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' ILE . . . . . 0.616 HD12 ' H ' ' B' ' 90' ' ' ILE . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt . . . . . 0 N--CA 1.446 -0.675 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB3' HD11 ' B' ' 22' ' ' ILE . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' B' ' 53' ' ' ILE . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.403 ' HB3' ' HA ' ' B' ' 2' ' ' ALA . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.443 HG21 HD23 ' A' ' 38' ' ' LEU . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.739 0 CA-C-O 119.061 -0.855 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' A' ' 56' ' ' PHE . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 47' ' ' GLU . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' B' ' 7' ' ' LEU . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.415 HD11 ' HB3' ' A' ' 29' ' ' LEU . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LEU . . . . . 0.419 HD22 HG11 ' B' ' 48' ' ' VAL . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 HD22 ' B' ' 38' ' ' LEU . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.471 HD12 ' HB3' ' A' ' 38' ' ' LEU . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.8 0 CA-C-O 120.098 -0.279 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' B' ' 53' ' ' ILE . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 25' ' ' GLN . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD21 ' B' ' 34' ' ' LEU . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.417 HD21 HG11 ' A' ' 48' ' ' VAL . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.46 HD21 ' HB3' ' A' ' 56' ' ' PHE . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.417 HG11 HD21 ' A' ' 38' ' ' LEU . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 53' ' ' ILE . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB3' HD21 ' A' ' 42' ' ' LEU . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t . . . . . 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 107.708 -2.157 . . . . 0.0 107.708 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.426 ' CB ' HD11 ' B' ' 83' ' ' ILE . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' B' ' 21' ' ' ASN 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.47 ' HB3' ' HB3' ' B' ' 18' ' ' ASP . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 31' ' ' VAL . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' B' ' 39' ' ' ALA . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.495 HD13 HG12 ' B' ' 83' ' ' ILE . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.425 HG23 HD21 ' B' ' 42' ' ' LEU . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA2' ' HB3' ' B' ' 88' ' ' SER . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.167 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.495 HG12 HD13 ' B' ' 42' ' ' LEU . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.413 ' HB3' ' HA2' ' B' ' 54' ' ' GLY . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' LYS . . . . . 0.481 ' HA ' HG22 ' B' ' 92' ' ' THR . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' THR . . . . . 0.481 HG22 ' HA ' ' B' ' 89' ' ' LYS . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 4' ' ' ILE . 23.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.446 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t . . . . . 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.34 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.426 HD11 HG21 ' B' ' 95' ' ' VAL . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 90' ' ' ILE . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.587 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.587 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.504 HD21 HG13 ' B' ' 27' ' ' ILE . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.504 HG13 HD21 ' B' ' 13' ' ' LEU . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.166 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 83' ' ' ILE . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.528 ' HG2' HD13 ' A' ' 7' ' ' LEU . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' B' ' 22' ' ' ILE . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.499 HG21 ' HB3' ' B' ' 26' ' ' ASP . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.583 0 N-CA-C 108.352 -1.899 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 85' ' ' LEU . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.482 HG23 HG22 ' A' ' 30' ' ' VAL 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.499 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.437 ' CG1' HD22 ' B' ' 34' ' ' LEU . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.437 HD22 ' CG1' ' B' ' 30' ' ' VAL . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' B' ' 42' ' ' LEU . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' B' ' 39' ' ' ALA . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.43 HG22 HD11 ' A' ' 7' ' ' LEU . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m . . . . . 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' LEU 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.457 0 CA-C-O 117.962 -1.465 . . . . 0.0 115.011 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' HIS . . . . . 0.417 ' ND1' ' HG2' ' B' ' 81' ' ' LYS . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.443 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' THR . . . . . 0.436 ' HA ' HE22 ' B' ' 35' ' ' GLN . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.436 HE22 ' HA ' ' B' ' 32' ' ' THR 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HG2' ' ND1' ' A' ' 98' ' ' HIS . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.415 HD13 ' HG3' ' B' ' 41' ' ' GLU . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.57 HG22 HG23 ' B' ' 22' ' ' ILE . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HB3' HD12 ' A' ' 53' ' ' ILE . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.587 HD12 ' HB3' ' A' ' 50' ' ' LEU . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t . . . . . 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 117.748 -1.584 . . . . 0.0 113.379 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.57 HG23 HG22 ' A' ' 30' ' ' VAL . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG3' HD13 ' A' ' 7' ' ' LEU . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HE2' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 33.7 tp60 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 27' ' ' ILE 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.414 HG23 ' CD2' ' B' ' 51' ' ' PHE . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' HG3' ' B' ' 11' ' ' GLU . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' H ' ' A' ' 50' ' ' LEU 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t . . . . . 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.382 0 CA-C-O 117.49 -1.728 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.44 HD12 HG11 ' B' ' 87' ' ' VAL . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' LYS 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 37' ' ' VAL . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' PHE . . . . . 0.414 ' CD2' HG23 ' A' ' 32' ' ' THR . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' PHE . . . . . 0.404 ' CZ ' HD13 ' B' ' 85' ' ' LEU . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 117.85 1.9 . . . . 0.0 117.85 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.404 HD13 ' CZ ' ' B' ' 56' ' ' PHE 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.44 HG11 HD12 ' A' ' 83' ' ' ILE . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 7' ' ' LEU . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.1 tp60 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.424 ' CB ' HD11 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HD22 ' A' ' 58' ' ' LEU 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 HG23 ' A' ' 45' ' ' THR . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.312 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.424 HD11 ' CB ' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' B' ' 91' ' ' LEU . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 31' ' ' VAL . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.418 HG22 HG12 ' B' ' 22' ' ' ILE . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 27' ' ' ILE . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.414 HD21 ' HB3' ' A' ' 56' ' ' PHE . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.414 ' HB3' HD21 ' A' ' 42' ' ' LEU 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.506 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.479 ' OG ' HG22 ' A' ' 90' ' ' ILE . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.479 HG22 ' OG ' ' A' ' 88' ' ' SER 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 30' ' ' VAL . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 44' ' ' THR . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' THR . . . . . 0.425 HG22 ' HA ' ' B' ' 41' ' ' GLU 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' THR . . . . . 0.446 HG23 ' HE3' ' B' ' 82' ' ' LYS . 6.6 m . . . . . 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.571 0 CA-C-O 122.807 1.226 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.446 ' HE3' HG23 ' B' ' 61' ' ' THR . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtp . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.77 130.78 37.15 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.624 2.369 . . . . 0.0 108.15 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -96.34 132.67 41.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp -151.18 173.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.926 1 C-N-CA 132.131 4.172 . . . . 0.0 104.121 176.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.648 HG13 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.648 ' H ' HG13 ' A' ' 24' ' ' VAL 0.259 54.7 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.456 ' HA ' HG22 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' B' ' 34' ' ' LEU . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t -126.67 146.61 50.13 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 28.2 m -98.88 105.09 17.2 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 105.148 -2.167 . . . . 0.0 105.148 167.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -52.19 151.48 6.97 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -74.62 147.71 36.1 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 122.132 1.797 . . . . 0.0 108.868 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER -144.82 130.8 19.3 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.057 1.343 . . . . 0.0 110.425 -175.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.7 t -48.87 125.8 10.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.278 2.231 . . . . 0.0 107.778 160.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -115.72 141.83 17.17 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-O 115.026 -3.097 . . . . 0.0 117.514 155.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 16.7 tt -134.28 125.0 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 119.885 1.842 . . . . 0.0 108.271 172.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -97.02 119.7 62.9 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 160.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.61 -36.26 18.42 Favored 'Trans proline' 0 N--CA 1.446 -1.315 1 C-N-CA 129.695 6.93 . . . . 0.0 119.465 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -80.65 -21.74 41.14 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -81.46 146.12 30.4 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 116.941 -3.599 . . . . 0.0 113.095 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -77.39 -34.03 54.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.772 1.169 . . . . 0.0 109.703 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -82.65 141.25 32.63 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.008 1.723 . . . . 0.0 111.112 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.6 mttp -97.21 103.94 15.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 128.216 2.606 . . . . 0.0 105.516 176.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.33 93.23 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 103.882 -2.636 . . . . 0.0 103.882 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -92.96 101.65 14.0 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 128.182 2.593 . . . . 0.0 108.963 174.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 77' ' ' ILE . 69.7 mt -70.15 120.17 76.49 Favored Pre-proline 0 N--CA 1.453 -0.305 0 O-C-N 119.868 -1.77 . . . . 0.0 108.831 -174.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.282 84.1 Cg_endo -66.65 -171.05 0.24 Allowed 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.594 3.53 . . . . 0.0 116.695 -177.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.324 . . -83.01 126.73 32.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.65 139.8 11.77 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 167.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.462 HG23 ' HA ' ' B' ' 82' ' ' LYS . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.494 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 12' ' ' TYR . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' A' ' 34' ' ' LEU . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.432 ' HA ' HG22 ' B' ' 44' ' ' THR . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' THR . . . . . 0.432 HG22 ' HA ' ' B' ' 41' ' ' GLU . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m -52.18 112.04 0.73 Allowed 'General case' 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.58 116.6 21.33 Favored Pre-proline 0 N--CA 1.454 -0.237 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -158.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.22 123.73 8.99 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 N-CA-C 108.674 -1.318 . . . . 0.0 108.674 -176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 33.9 ttp85 -77.44 159.63 29.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 112.836 -1.983 . . . . 0.0 111.346 167.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -100.4 139.79 35.58 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 116.954 -3.591 . . . . 0.0 103.817 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -124.73 145.73 15.88 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.302 -2.719 . . . . 0.0 106.302 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 23.7 mm -106.32 93.04 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 1 N-CA-C 98.858 -4.497 . . . . 0.0 98.858 168.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -96.29 141.06 22.59 Favored Pre-proline 0 C--O 1.221 -0.418 0 C-N-CA 127.948 2.499 . . . . 0.0 109.574 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . 0.305 60.5 Cg_endo -56.55 99.05 0.08 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.278 1 C-N-CA 126.19 4.593 . . . . 0.0 115.256 -177.762 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.416 47.2 tptt -150.21 -101.24 0.07 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.366 2.266 . . . . 0.0 112.128 169.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 84.8 m -113.69 174.02 6.13 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.193 1.797 . . . . 0.0 111.584 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -39.89 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 118.39 2.737 . . . . 0.0 118.39 167.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -70.6 149.03 47.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 129.542 3.137 . . . . 0.0 107.208 -175.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -87.03 143.37 27.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 124.349 2.023 . . . . 0.0 109.071 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -119.98 121.09 65.07 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 O-C-N 119.573 -1.954 . . . . 0.0 106.685 -172.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -73.62 137.82 44.46 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.278 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.85 134.99 85.62 Favored Pre-proline 0 N--CA 1.443 -0.815 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 163.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -65.58 130.24 24.49 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.693 1.595 . . . . 0.0 111.409 -160.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.316 . . -83.81 153.49 24.04 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 117.564 -3.21 . . . . 0.0 114.442 169.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.12 122.09 7.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 167.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.462 ' HA ' HG23 ' A' ' 92' ' ' THR . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m -79.85 130.79 35.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -80.61 136.32 36.22 Favored 'General case' 0 N--CA 1.453 -0.31 1 O-C-N 115.786 -4.321 . . . . 0.0 105.383 -178.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--O 1.254 1.307 0 CA-C-N 124.313 3.233 . . . . 0.0 108.313 172.289 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.47 140.92 43.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.911 2.085 . . . . 0.0 107.115 166.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 0.472 77.2 mttt -125.01 153.86 42.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.112 2.133 . . . . 0.0 113.315 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt -165.98 148.37 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 O-C-N 118.223 -2.798 . . . . 0.0 103.718 168.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 27' ' ' ILE . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD21 HG22 ' B' ' 31' ' ' VAL . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' HD2' ' B' ' 3' ' ' LYS . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 45' ' ' THR . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 44' ' ' THR 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' B' ' 5' ' ' LYS . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 53' ' ' ILE . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t -143.15 101.25 3.78 Favored 'General case' 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.283 4.5 p -79.17 122.92 26.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.509 1.124 . . . . 0.0 108.197 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.2 pttt -73.1 156.59 89.37 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 120.879 1.672 . . . . 0.0 112.728 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.91 150.58 83.03 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.888 1.725 . . . . 0.0 109.701 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -160.11 169.82 22.52 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 -155.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.289 2.9 t -146.94 134.57 21.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.77 2.224 . . . . 0.0 108.548 -172.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.88 175.15 18.48 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-O 116.504 -2.276 . . . . 0.0 110.729 160.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 pt -97.52 164.56 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 122.722 3.261 . . . . 0.0 110.115 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -80.64 148.93 66.9 Favored Pre-proline 0 N--CA 1.451 -0.406 0 O-C-N 118.808 -2.432 . . . . 0.0 109.173 165.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -83.45 -26.15 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 CA-C-N 122.476 1.92 . . . . 0.0 114.98 -159.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.291 32.7 mtmt -124.5 -10.55 7.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 119.795 1.18 . . . . 0.0 110.371 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 80.3 p -109.82 172.09 7.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 122.05 2.205 . . . . 0.0 108.326 163.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -93.03 -19.36 21.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.112 -1.618 . . . . 0.0 111.504 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -57.32 138.51 54.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -84.69 144.13 28.74 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 118.61 -2.556 . . . . 0.0 107.309 -176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.0 mt -84.0 129.03 38.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 167.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 125.57 41.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 118.855 -1.138 . . . . 0.0 110.46 162.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 mt -89.79 142.37 29.07 Favored Pre-proline 0 N--CA 1.453 -0.303 0 CA-C-O 116.061 -1.923 . . . . 0.0 108.116 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.34 173.72 12.14 Favored 'Trans proline' 0 N--CA 1.439 -1.719 1 C-N-CA 126.244 4.629 . . . . 0.0 113.833 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.7 121.35 27.54 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 100.503 -3.888 . . . . 0.0 100.503 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -111.39 140.39 16.06 Favored Glycine 0 C--N 1.335 0.525 0 O-C-N 119.462 -2.024 . . . . 0.0 111.642 173.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' LYS . . . . . 0.51 ' HD2' ' HG2' ' A' ' 41' ' ' GLU . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.426 ' HG3' HD22 ' A' ' 50' ' ' LEU . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.408 ' O ' HG22 ' B' ' 32' ' ' THR . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.742 HG22 HD21 ' A' ' 34' ' ' LEU . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' THR . . . . . 0.408 HG22 ' O ' ' B' ' 28' ' ' ARG . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m -96.11 145.25 25.65 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -63.45 134.89 96.02 Favored Pre-proline 0 N--CA 1.44 -0.925 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.96 155.95 38.68 Favored 'Trans proline' 0 N--CA 1.445 -1.372 0 CA-C-N 121.297 1.499 . . . . 0.0 115.493 178.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -73.98 148.93 41.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 126.847 2.059 . . . . 0.0 114.002 160.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t -100.72 154.09 18.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 124.376 2.036 . . . . 0.0 109.068 172.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -136.69 163.34 25.24 Favored Glycine 0 N--CA 1.447 -0.608 1 C-N-CA 131.451 4.358 . . . . 0.0 109.064 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -126.43 136.88 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 127.064 2.146 . . . . 0.0 105.792 170.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -80.68 131.9 59.52 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-O 117.152 -1.404 . . . . 0.0 109.299 170.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -81.79 4.08 7.31 Favored 'Trans proline' 0 N--CA 1.45 -1.045 0 N-CA-C 117.32 2.008 . . . . 0.0 117.32 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -94.58 -57.15 2.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 121.197 -0.939 . . . . 0.0 110.381 -172.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.8 t -137.61 154.43 49.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.084 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . 0.309 13.5 ttpt -48.32 73.65 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 117.727 2.491 . . . . 0.0 117.727 168.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -138.43 147.63 43.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 167.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -98.31 145.88 26.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 119.168 -2.208 . . . . 0.0 107.331 -160.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -126.17 129.2 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 129.084 2.953 . . . . 0.0 105.105 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.303 8.2 tt0 -103.41 116.03 31.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.683 -2.71 . . . . 0.0 103.683 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 8.3 mt -104.36 128.4 27.1 Favored Pre-proline 0 N--CA 1.453 -0.285 1 CA-C-O 111.269 -4.205 . . . . 0.0 107.918 -172.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -80.74 165.79 19.85 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 O-C-N 127.096 3.156 . . . . 0.0 109.045 -169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -140.83 -20.34 0.81 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 110.949 -2.841 . . . . 0.0 115.673 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 148.86 113.99 0.72 Allowed Glycine 0 C--N 1.336 0.573 0 CA-C-N 120.36 1.436 . . . . 0.0 115.423 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m -68.14 121.29 15.86 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -76.9 110.76 11.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.74 3.216 . . . . 0.0 108.726 168.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 pttt . . . . . 0 C--O 1.258 1.505 0 C-N-CA 128.75 2.82 . . . . 0.0 109.676 172.103 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 102.255 -3.239 . . . . 0.0 102.255 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.47 137.7 38.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 167.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -85.29 98.71 10.68 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt -163.82 135.22 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.206 3.441 . . . . 0.0 110.342 -175.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.638 HG11 HG21 ' B' ' 30' ' ' VAL . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.454 HD22 HD12 ' A' ' 83' ' ' ILE . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.447 HD22 ' HG3' ' B' ' 5' ' ' LYS . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t -162.87 148.83 12.23 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.4 p -117.29 138.46 51.73 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 123.299 1.523 . . . . 0.0 114.58 167.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 62' ' ' LYS . 26.6 pttt -70.87 152.17 95.08 Favored Pre-proline 0 N--CA 1.445 -0.686 0 O-C-N 119.549 -1.969 . . . . 0.0 114.933 175.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -75.57 150.76 36.22 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 O-C-N 125.922 2.538 . . . . 0.0 113.015 176.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -150.96 170.47 19.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 130.973 3.709 . . . . 0.0 108.98 -166.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.301 10.1 t -138.61 147.24 42.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 168.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -125.79 -170.39 13.01 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 130.354 3.835 . . . . 0.0 112.311 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 19.1 pt -128.49 163.6 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 117.938 -1.505 . . . . 0.0 110.994 168.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -83.3 154.74 66.58 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 125.427 1.491 . . . . 0.0 114.7 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . 0.264 32.2 Cg_endo -75.34 -22.59 14.07 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 N-CA-C 121.269 3.526 . . . . 0.0 121.269 -175.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.285 81.3 mttt -142.42 13.3 1.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 124.945 2.307 . . . . 0.0 113.81 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.338 46.3 p -134.11 145.57 49.45 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 131.689 3.996 . . . . 0.0 114.394 177.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -73.17 -11.79 60.65 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.981 2.113 . . . . 0.0 115.337 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -66.13 146.11 55.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 126.893 3.235 . . . . 0.0 111.777 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.4 mtpt -75.27 144.38 42.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 111.973 -2.376 . . . . 0.0 106.162 165.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 63.5 mt -92.1 128.29 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 125.81 1.644 . . . . 0.0 106.597 153.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -94.72 116.68 29.04 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 165.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.6 mp -91.08 121.74 67.46 Favored Pre-proline 0 N--CA 1.451 -0.391 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -76.04 178.66 7.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 1 C-N-CA 125.997 4.465 . . . . 0.0 115.287 -175.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -93.52 121.01 34.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.032 2.933 . . . . 0.0 103.946 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.51 154.58 19.66 Favored Glycine 0 C--N 1.341 0.821 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 HD22 ' A' ' 42' ' ' LEU . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.501 HG11 HD12 ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 93' ' ' ASP . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 91' ' ' LEU . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HG ' HG23 ' A' ' 90' ' ' ILE . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 89' ' ' LYS . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.447 ' HG3' HD22 ' A' ' 50' ' ' LEU . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.517 HD13 HG21 ' B' ' 22' ' ' ILE . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.638 HG21 HG11 ' A' ' 30' ' ' VAL . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' THR . . . . . 0.453 ' CG2' HG23 ' B' ' 60' ' ' THR 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' THR . . . . . 0.453 HG23 ' CG2' ' B' ' 45' ' ' THR . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m -82.95 149.44 27.02 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 35.6 pttt -61.63 128.49 90.25 Favored Pre-proline 0 C--O 1.234 0.287 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -172.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.62 -168.44 0.4 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 123.2 2.6 . . . . 0.0 116.862 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 40.2 ttp85 -162.63 151.23 14.62 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 130.644 3.578 . . . . 0.0 108.857 170.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 9.9 t -131.08 141.06 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.131 -2.231 . . . . 0.0 109.127 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.13 -170.79 12.25 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 103.956 -3.657 . . . . 0.0 103.956 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.313 2.6 tt -143.84 137.83 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 128.78 2.832 . . . . 0.0 109.316 -173.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -76.86 127.04 84.9 Favored Pre-proline 0 N--CA 1.446 -0.633 0 C-N-CA 130.938 3.695 . . . . 0.0 108.839 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -81.21 -17.92 8.89 Favored 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 124.335 3.357 . . . . 0.0 116.2 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -96.19 -20.99 18.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 128.907 2.883 . . . . 0.0 111.337 -165.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 7.0 t -162.44 149.79 13.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 8.2 tptt -86.48 79.01 9.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 126.854 3.216 . . . . 0.0 109.607 -154.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.95 135.69 27.78 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 119.32 -2.113 . . . . 0.0 113.103 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mtpt -87.04 131.62 34.05 Favored 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.235 4.214 . . . . 0.0 104.681 171.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.18 118.62 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 103.731 -2.692 . . . . 0.0 103.731 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -87.91 125.05 34.28 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 164.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.2 mt -112.32 129.01 24.75 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 128.454 2.702 . . . . 0.0 105.014 -174.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -89.84 157.21 5.03 Favored 'Trans proline' 0 N--CA 1.441 -1.572 0 C-N-CA 124.238 3.292 . . . . 0.0 111.023 172.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -103.86 -10.39 18.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 128.153 2.581 . . . . 0.0 112.872 159.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.23 150.3 8.32 Favored Glycine 0 N--CA 1.447 -0.613 1 C-N-CA 131.247 4.26 . . . . 0.0 120.573 166.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t -64.05 91.14 0.07 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.97 116.42 13.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.634 -1.166 . . . . 0.0 113.931 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 ptpt . . . . . 0 C--O 1.246 0.89 0 C-N-CA 130.843 3.657 . . . . 0.0 112.825 171.581 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 N--CA 1.466 0.354 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.45 145.07 27.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 116.313 1.968 . . . . 0.0 116.313 171.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -85.74 155.99 20.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 128.632 2.773 . . . . 0.0 108.014 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt -136.65 138.84 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 126.993 2.117 . . . . 0.0 112.229 -172.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.438 HD12 ' N ' ' A' ' 27' ' ' ILE . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t -158.35 143.31 16.35 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.0 p -102.13 131.44 48.63 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 130.908 3.683 . . . . 0.0 106.512 164.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -83.93 166.5 33.41 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 115.676 -2.107 . . . . 0.0 112.36 -168.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -80.72 146.2 16.57 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 CA-C-N 121.514 1.577 . . . . 0.0 111.747 172.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.463 HH11 ' HD2' ' A' ' 64' ' ' ARG . 45.1 mtm180 -141.34 165.91 26.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -170.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.276 7.3 t -142.2 -172.04 3.51 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 127.432 2.293 . . . . 0.0 108.349 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.27 -160.54 26.84 Favored Glycine 0 C--N 1.337 0.637 0 C-N-CA 126.765 2.126 . . . . 0.0 110.947 -169.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.5 mt -136.4 137.05 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.338 3.455 . . . . 0.0 105.52 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -76.29 159.83 79.16 Favored Pre-proline 0 N--CA 1.446 -0.635 0 CA-C-O 123.278 1.513 . . . . 0.0 110.783 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -82.0 -26.7 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.773 1 C-N-CA 125.779 4.319 . . . . 0.0 115.873 -168.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 mttt -128.03 9.73 6.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.05 2.14 . . . . 0.0 109.729 -175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 28.1 p -136.87 152.14 49.9 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 118.995 -2.316 . . . . 0.0 107.509 166.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 ttpt -93.86 6.58 47.96 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 114.892 -2.48 . . . . 0.0 107.949 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -75.28 164.06 26.83 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 123.185 2.72 . . . . 0.0 112.92 169.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -78.98 149.18 32.33 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 112.977 -1.92 . . . . 0.0 106.199 -170.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.9 mt -89.12 131.85 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 164.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -134.29 90.78 2.72 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.538 -2.393 . . . . 0.0 104.538 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 91.7 mt -93.61 120.76 65.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 104.784 -2.302 . . . . 0.0 104.784 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.26 16.3 Cg_endo -80.51 176.8 8.78 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 O-C-N 125.085 2.097 . . . . 0.0 114.996 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.262 . . -77.56 138.53 39.22 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.857 1.663 . . . . 0.0 110.966 164.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.95 159.08 15.1 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.489 ' N ' HD12 ' B' ' 22' ' ' ILE . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.71 HD21 HG23 ' B' ' 48' ' ' VAL . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.71 HG23 HD21 ' B' ' 42' ' ' LEU . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m -109.6 140.43 43.43 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HD2' ' B' ' 63' ' ' PRO . 16.7 pttt -67.43 154.74 92.49 Favored Pre-proline 0 N--CA 1.445 -0.696 0 C-N-CA 124.06 0.944 . . . . 0.0 111.665 -175.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 62' ' ' LYS 0.288 30.2 Cg_endo -82.6 157.2 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 124.509 3.472 . . . . 0.0 113.56 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 36.5 ttp85 -87.2 146.08 26.14 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.316 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.332 11.8 t -139.78 -153.22 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -163.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.44 16.65 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 129.098 3.237 . . . . 0.0 111.003 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 40.6 mm -108.01 128.51 63.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 126.565 1.946 . . . . 0.0 107.009 -174.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -63.21 124.22 83.27 Favored Pre-proline 0 N--CA 1.44 -0.951 0 C-N-CA 126.903 2.081 . . . . 0.0 113.185 170.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -83.84 -15.54 6.98 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-O 112.95 -3.021 . . . . 0.0 114.804 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -95.17 -15.42 23.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 125.932 2.02 . . . . 0.0 112.825 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.4 t -156.66 139.54 15.26 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -67.09 69.3 0.08 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 129.084 2.953 . . . . 0.0 116.882 -165.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -154.78 160.52 41.35 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -168.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -92.52 141.64 28.28 Favored 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 132.87 4.468 . . . . 0.0 103.531 177.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 6.2 mt -110.73 140.13 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 O-C-N 127.918 3.261 . . . . 0.0 102.494 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -127.5 118.17 23.51 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.102 2.961 . . . . 0.0 109.488 155.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -98.7 126.47 38.8 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-O 113.091 -3.337 . . . . 0.0 105.642 168.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.03 160.17 33.56 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 CA-C-N 126.892 3.497 . . . . 0.0 113.367 175.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -89.26 -29.73 19.01 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 130.754 3.622 . . . . 0.0 111.057 171.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.47 162.1 11.21 Favored Glycine 0 N--CA 1.446 -0.695 0 O-C-N 127.116 2.76 . . . . 0.0 108.972 176.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t -73.86 109.13 7.12 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -82.91 108.08 15.98 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 172.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 15.3 pttp . . . . . 0 C--O 1.252 1.2 0 C-N-CA 130.295 3.438 . . . . 0.0 106.777 172.109 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.347 7.2 ttt . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.0 133.53 51.0 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.606 1.562 . . . . 0.0 115.082 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.53 176.57 6.41 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 122.194 2.27 . . . . 0.0 111.259 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt -81.48 149.03 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 166.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.418 ' HB3' HD11 ' B' ' 22' ' ' ILE . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 27' ' ' ILE . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.571 HG21 ' HD1' ' B' ' 12' ' ' TYR . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t -127.06 117.91 23.38 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.8 p -88.85 144.22 26.36 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 124.65 1.18 . . . . 0.0 108.964 -169.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 pttt -82.01 156.51 69.6 Favored Pre-proline 0 C--O 1.224 -0.252 0 O-C-N 121.478 -0.764 . . . . 0.0 112.558 -169.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.02 168.7 23.25 Favored 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 121.915 1.743 . . . . 0.0 110.813 171.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -153.9 169.88 22.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 125.368 2.508 . . . . 0.0 107.081 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.365 8.5 t -135.84 137.26 41.33 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.362 -1.744 . . . . 0.0 112.309 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.68 172.08 14.69 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-O 124.744 2.302 . . . . 0.0 107.393 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 mt -129.89 146.53 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 1 O-C-N 115.228 -4.69 . . . . 0.0 105.842 173.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -85.66 166.23 31.03 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 123.449 0.7 . . . . 0.0 111.0 -176.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -86.61 -43.87 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 CA-C-N 120.731 1.297 . . . . 0.0 112.384 -169.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.2 mttp -94.13 -12.47 28.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 117.375 -3.328 . . . . 0.0 114.521 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.8 p -130.83 148.23 52.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 128.699 2.8 . . . . 0.0 107.928 -174.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.302 76.3 mttt -78.79 -1.41 34.67 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.095 -1.628 . . . . 0.0 112.072 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -40.9 127.7 2.63 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.112 3.004 . . . . 0.0 119.112 170.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -70.92 149.51 46.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 128.346 2.659 . . . . 0.0 114.932 -177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.8 mt -126.85 143.27 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 113.122 -1.854 . . . . 0.0 106.169 168.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -113.22 129.05 56.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.696 2.398 . . . . 0.0 105.481 172.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.6 123.92 37.89 Favored Pre-proline 0 N--CA 1.443 -0.824 0 N-CA-C 100.659 -3.83 . . . . 0.0 100.659 173.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.34 160.1 50.49 Favored 'Trans proline' 0 N--CA 1.452 -0.955 1 C-N-CA 127.055 5.17 . . . . 0.0 114.585 173.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.34 130.36 37.03 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 131.243 3.817 . . . . 0.0 110.51 170.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.48 -170.88 14.99 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 130.494 3.902 . . . . 0.0 110.759 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.509 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.571 ' HD1' HG21 ' A' ' 37' ' ' VAL . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 29' ' ' LEU . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 34' ' ' LEU . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.602 HD21 ' HD2' ' B' ' 81' ' ' LYS 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m -74.84 149.53 39.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -52.18 157.08 2.41 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.4 155.93 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.38 0 C-N-CA 122.183 1.922 . . . . 0.0 109.661 -174.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -80.1 125.01 29.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 151.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.385 12.1 t -136.17 -160.29 1.04 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.101 1.76 . . . . 0.0 111.279 -177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.0 -176.72 19.14 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 125.38 1.467 . . . . 0.0 113.53 -164.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -99.27 134.32 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 101.332 -3.581 . . . . 0.0 101.332 163.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -77.67 139.32 62.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 113.826 -2.988 . . . . 0.0 112.259 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.51 -34.61 0.51 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.154 2.569 . . . . 0.0 117.496 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -83.06 -20.15 35.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 122.724 2.511 . . . . 0.0 116.079 -175.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.306 14.3 t -149.49 155.17 39.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 115.502 -2.189 . . . . 0.0 110.766 168.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -73.35 90.02 1.64 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 129.162 2.985 . . . . 0.0 113.605 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -167.19 168.1 13.75 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 129.604 3.161 . . . . 0.0 115.308 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -96.25 134.46 39.33 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 32.3 mt -75.24 139.51 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.62 2.368 . . . . 0.0 107.407 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -145.75 64.65 1.24 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.707 2.403 . . . . 0.0 114.661 -167.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.13 122.54 41.15 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 117.06 -1.447 . . . . 0.0 109.364 -167.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -78.67 164.27 25.9 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 C-N-CA 122.362 2.041 . . . . 0.0 111.964 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.252 . . -135.03 -2.39 2.57 Favored 'General case' 0 N--CA 1.446 -0.673 2 C-N-CA 134.121 4.968 . . . . 0.0 115.095 -160.391 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.03 167.9 16.27 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 128.725 3.06 . . . . 0.0 111.472 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' LYS . . . . . 0.602 ' HD2' HD21 ' B' ' 58' ' ' LEU . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.448 ' H ' HG13 ' B' ' 83' ' ' ILE . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.631 HD12 ' H ' ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t -72.24 152.2 42.35 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.299 2.2 t60 -148.23 164.14 34.89 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.435 1.894 . . . . 0.0 112.656 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.486 2.714 . . . . 0.0 108.195 173.492 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 ttm . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 132.33 42.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.996 2.518 . . . . 0.0 109.136 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -80.66 133.63 35.75 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.276 3.031 . . . . 0.0 103.307 172.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt -90.94 130.01 40.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 127.755 2.422 . . . . 0.0 110.611 172.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.3 150.05 35.02 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.0 p -107.54 141.39 39.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.219 3.007 . . . . 0.0 108.854 156.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -74.91 166.05 48.68 Favored Pre-proline 0 N--CA 1.453 -0.311 0 O-C-N 126.544 2.403 . . . . 0.0 109.874 -161.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.268 19.5 Cg_endo -80.74 165.64 19.95 Favored 'Trans proline' 0 N--CA 1.45 -1.059 0 N-CA-C 106.086 -2.313 . . . . 0.0 106.086 174.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.293 69.7 mtm180 -145.45 158.13 43.89 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 129.174 2.99 . . . . 0.0 113.446 -173.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.495 4.4 t -134.83 149.32 50.34 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 118.356 -2.715 . . . . 0.0 111.558 160.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -137.88 -163.0 9.47 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 116.43 -2.317 . . . . 0.0 114.383 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.0 mt -115.52 133.14 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 123.557 1.646 . . . . 0.0 108.883 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -66.0 124.93 89.05 Favored Pre-proline 0 N--CA 1.451 -0.398 0 O-C-N 119.184 -2.197 . . . . 0.0 112.772 158.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.56 -33.41 46.02 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.926 3.751 . . . . 0.0 116.857 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -89.09 -31.81 17.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 119.613 -1.929 . . . . 0.0 110.88 -165.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 65.1 p -139.89 178.16 7.45 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 128.516 2.726 . . . . 0.0 107.742 -174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -101.35 55.76 0.83 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 124.28 1.99 . . . . 0.0 110.0 -168.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -103.14 142.98 33.22 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 175.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -91.36 131.52 36.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 129.09 2.956 . . . . 0.0 111.848 165.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.0 mt -105.29 117.92 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 100.767 -3.79 . . . . 0.0 100.767 -174.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -88.2 108.72 19.43 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 122.644 1.211 . . . . 0.0 111.417 164.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.0 mt -95.72 130.81 30.71 Favored Pre-proline 0 N--CA 1.445 -0.715 0 N-CA-C 101.851 -3.388 . . . . 0.0 101.851 176.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -87.82 161.86 7.61 Favored 'Trans proline' 0 N--CA 1.446 -1.312 0 C-N-CA 122.853 2.369 . . . . 0.0 108.491 -169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -75.48 164.56 26.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.827 1.651 . . . . 0.0 112.393 165.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.59 150.25 17.77 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 -166.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.907 HG23 HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.537 ' O ' HG22 ' A' ' 92' ' ' THR . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.907 HG21 HG23 ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m -101.01 139.98 35.95 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' B' ' 63' ' ' PRO . 0.0 OUTLIER -62.57 145.48 95.01 Favored Pre-proline 0 CA--C 1.517 -0.315 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.157 170.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 63' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' B' ' 62' ' ' LYS . 70.8 Cg_endo -81.53 169.05 15.79 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 124.621 3.548 . . . . 0.0 112.915 -157.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -101.26 109.75 21.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 125.152 1.381 . . . . 0.0 107.696 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.494 14.0 t -126.45 -175.7 3.46 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.405 -2.18 . . . . 0.0 114.289 -175.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.5 -162.49 22.75 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 128.433 2.92 . . . . 0.0 106.96 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 30.7 mm -85.77 131.5 34.25 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 C-N-CA 128.291 2.636 . . . . 0.0 108.307 176.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -71.17 126.8 91.96 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-O 114.8 -2.524 . . . . 0.0 108.183 169.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -71.21 -34.67 9.7 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 O-C-N 124.565 1.824 . . . . 0.0 113.011 -168.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -86.95 -22.53 25.55 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.877 -3.015 . . . . 0.0 111.202 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.319 2.4 t -152.97 162.85 40.82 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.577 2.751 . . . . 0.0 110.707 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -73.86 78.49 1.62 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 125.14 2.4 . . . . 0.0 113.564 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.335 3.7 pt20 -144.37 178.75 7.71 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.616 -1.928 . . . . 0.0 110.068 172.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -92.27 150.9 20.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 128.294 2.638 . . . . 0.0 115.054 161.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 13.2 mt -69.18 128.1 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 125.701 1.876 . . . . 0.0 109.915 153.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.344 25.7 mt-30 -138.18 65.98 1.45 Allowed 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 56.3 mt -108.53 137.28 19.94 Favored Pre-proline 0 N--CA 1.447 -0.616 0 N-CA-C 104.092 -2.558 . . . . 0.0 104.092 -169.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -66.88 138.5 48.63 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.314 3.343 . . . . 0.0 113.387 175.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.85 -21.41 29.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 121.523 1.965 . . . . 0.0 109.976 167.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 113.55 167.95 16.64 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' ILE . . . . . 0.616 HD12 ' H ' ' B' ' 90' ' ' ILE . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t -64.25 146.89 53.59 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -156.66 104.76 2.18 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 112.813 -3.47 . . . . 0.0 107.883 167.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 C--O 1.251 1.136 0 C-N-CA 128.943 2.897 . . . . 0.0 109.736 171.425 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.361 6.0 ttt . . . . . 0 N--CA 1.466 0.329 0 CA-C-O 120.496 0.189 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.87 155.81 37.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -74.65 111.64 10.05 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.038 1.735 . . . . 0.0 111.511 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt -69.25 124.41 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 O-C-N 126.463 2.352 . . . . 0.0 105.608 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB3' HD11 ' B' ' 22' ' ' ILE . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' B' ' 53' ' ' ILE . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.403 ' HB3' ' HA ' ' B' ' 2' ' ' ALA . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.443 HG21 HD23 ' A' ' 38' ' ' LEU . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t -145.78 144.74 30.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.6 p -113.85 132.46 55.89 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 131.622 3.969 . . . . 0.0 107.847 -173.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -52.5 136.8 42.32 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 129.959 3.303 . . . . 0.0 113.841 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -71.81 157.01 56.15 Favored 'Trans proline' 0 N--CA 1.447 -1.257 0 C-N-CA 122.199 1.933 . . . . 0.0 114.526 166.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.8 mtm105 -142.78 -172.94 3.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 170.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.275 15.0 t -134.7 144.25 47.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.006 2.522 . . . . 0.0 104.963 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.96 -177.43 15.42 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 129.005 3.193 . . . . 0.0 110.969 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.2 mt -135.22 148.38 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 127.847 2.459 . . . . 0.0 106.177 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.09 133.61 78.32 Favored Pre-proline 0 N--CA 1.45 -0.463 0 N-CA-C 103.557 -2.757 . . . . 0.0 103.557 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.08 -9.75 27.2 Favored 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 123.637 2.891 . . . . 0.0 118.393 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tttp -117.79 -53.04 2.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.344 -1.789 . . . . 0.0 113.491 -171.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 61.4 p -100.78 161.29 13.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.467 1.939 . . . . 0.0 109.582 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -78.73 79.4 5.14 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -136.83 152.36 50.18 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 122.953 1.359 . . . . 0.0 113.118 167.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -82.6 157.67 23.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 120.229 -1.544 . . . . 0.0 110.785 172.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.4 mt -123.59 141.25 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 126.84 2.056 . . . . 0.0 106.143 172.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -126.44 125.39 42.06 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 118.597 0.635 . . . . 0.0 112.403 -173.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 12.0 mt -113.27 110.64 50.6 Favored Pre-proline 0 C--O 1.221 -0.435 0 N-CA-C 101.293 -3.595 . . . . 0.0 101.293 -171.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.64 165.4 27.05 Favored 'Trans proline' 0 N--CA 1.441 -1.568 1 C-N-CA 125.925 4.417 . . . . 0.0 112.206 -176.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.02 122.11 24.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 119.793 -1.817 . . . . 0.0 110.366 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -106.63 152.15 16.95 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 120.853 -1.154 . . . . 0.0 112.211 -164.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' A' ' 56' ' ' PHE . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 47' ' ' GLU . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' B' ' 7' ' ' LEU . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.415 HD11 ' HB3' ' A' ' 29' ' ' LEU . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LEU . . . . . 0.419 HD22 HG11 ' B' ' 48' ' ' VAL . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 HD22 ' B' ' 38' ' ' LEU . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.471 HD12 ' HB3' ' A' ' 38' ' ' LEU . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -88.77 141.12 28.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -51.42 147.42 10.56 Favored Pre-proline 0 N--CA 1.448 -0.533 0 O-C-N 118.361 -2.712 . . . . 0.0 111.16 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -69.72 149.53 67.26 Favored 'Trans proline' 0 N--CA 1.448 -1.168 0 CA-C-O 124.797 1.915 . . . . 0.0 112.334 -178.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -70.48 121.45 17.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.94 -1.482 . . . . 0.0 108.384 166.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 12.9 t -121.99 -137.54 0.31 Allowed 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 116.468 -3.895 . . . . 0.0 112.294 -175.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.38 163.21 20.85 Favored Glycine 0 CA--C 1.527 0.784 1 O-C-N 116.207 -4.058 . . . . 0.0 109.313 -177.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.89 145.02 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 167.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -80.3 129.56 68.98 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 127.847 3.217 . . . . 0.0 107.42 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -84.63 -26.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 0 CA-C-O 118.04 -0.9 . . . . 0.0 110.332 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -77.4 -29.14 52.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 117.881 2.548 . . . . 0.0 117.881 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.3 t -148.18 160.87 42.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.11 2.564 . . . . 0.0 108.469 162.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -78.33 103.04 8.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.853 0.751 . . . . 0.0 109.663 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -165.7 173.5 10.7 Favored 'General case' 0 N--CA 1.448 -0.546 1 C-N-CA 131.71 4.004 . . . . 0.0 107.697 -176.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -101.89 129.43 48.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 125.202 1.564 . . . . 0.0 109.73 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 26.6 mt -70.03 148.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 O-C-N 125.656 1.847 . . . . 0.0 113.632 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -160.58 73.63 0.5 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 104.397 -2.446 . . . . 0.0 104.397 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 91.2 mt -107.75 129.14 24.6 Favored Pre-proline 0 N--CA 1.446 -0.671 0 C-N-CA 128.02 2.528 . . . . 0.0 106.597 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.75 141.93 34.76 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.637 2.891 . . . . 0.0 108.749 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -86.49 -38.57 17.14 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.744 2.418 . . . . 0.0 116.861 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.25 -177.85 19.26 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.856 1.693 . . . . 0.0 112.949 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' B' ' 53' ' ' ILE . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m -77.18 155.42 32.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.316 58.7 t60 -143.95 154.39 43.26 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.561 2.344 . . . . 0.0 113.379 -178.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.294 18.5 ptmt . . . . . 0 C--O 1.253 1.249 0 CA-C-N 114.29 -1.323 . . . . 0.0 107.852 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.3 ttm . . . . . 0 N--CA 1.467 0.392 1 N-CA-C 100.165 -4.013 . . . . 0.0 100.165 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.09 109.07 18.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -139.52 141.11 37.32 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.119 2.168 . . . . 0.0 111.113 -177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt -92.23 105.45 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 C-N-CA 129.413 3.085 . . . . 0.0 109.035 171.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 25' ' ' GLN . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD21 ' B' ' 34' ' ' LEU . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.417 HD21 HG11 ' A' ' 48' ' ' VAL . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.46 HD21 ' HB3' ' A' ' 56' ' ' PHE . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.417 HG11 HD21 ' A' ' 38' ' ' LEU . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 53' ' ' ILE . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB3' HD21 ' A' ' 42' ' ' LEU . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t -135.93 152.66 51.22 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.6 p -116.96 112.16 20.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 113.892 -2.956 . . . . 0.0 108.737 173.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.298 31.6 pttt -35.21 135.18 0.45 Allowed Pre-proline 0 N--CA 1.446 -0.673 0 C-N-CA 130.075 3.35 . . . . 0.0 118.118 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.21 178.43 4.85 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 CA-C-O 124.636 1.848 . . . . 0.0 110.165 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -130.37 -179.05 5.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.033 2.133 . . . . 0.0 111.945 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.8 t -155.87 146.14 21.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 129.98 3.312 . . . . 0.0 112.44 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.79 -162.48 9.83 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 117.829 -2.129 . . . . 0.0 111.817 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.8 pt -140.22 148.82 22.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 131.485 3.914 . . . . 0.0 109.53 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -79.44 153.43 76.37 Favored Pre-proline 0 N--CA 1.446 -0.658 0 C-N-CA 131.062 3.745 . . . . 0.0 105.988 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -89.03 -15.52 2.48 Favored 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 125.236 3.958 . . . . 0.0 115.96 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -89.33 -52.63 4.94 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.311 -3.368 . . . . 0.0 111.283 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.7 p -126.37 152.71 45.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 127.756 3.16 . . . . 0.0 107.16 -165.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -70.27 37.22 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 123.88 1.8 . . . . 0.0 114.504 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -88.83 141.43 28.51 Favored 'General case' 0 N--CA 1.445 -0.721 1 O-C-N 114.639 -5.038 . . . . 0.0 104.197 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -100.73 128.35 46.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 129.284 3.034 . . . . 0.0 103.887 175.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 19.1 mt -92.25 128.4 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 116.79 -1.576 . . . . 0.0 107.744 173.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -103.33 142.01 34.95 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.9 mt -133.55 121.84 16.49 Favored Pre-proline 0 N--CA 1.45 -0.462 0 CA-C-O 112.559 -3.591 . . . . 0.0 109.591 -161.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -92.63 174.58 1.93 Allowed 'Trans proline' 0 N--CA 1.445 -1.349 0 O-C-N 125.518 2.325 . . . . 0.0 110.997 -159.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.21 167.7 16.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 109.957 -3.292 . . . . 0.0 110.445 -171.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.13 127.52 6.5 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 122.206 2.276 . . . . 0.0 107.708 166.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.426 ' CB ' HD11 ' B' ' 83' ' ' ILE . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' B' ' 21' ' ' ASN 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.47 ' HB3' ' HB3' ' B' ' 18' ' ' ASP . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 31' ' ' VAL . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' B' ' 39' ' ' ALA . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.495 HD13 HG12 ' B' ' 83' ' ' ILE . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.425 HG23 HD21 ' B' ' 42' ' ' LEU . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA2' ' HB3' ' B' ' 88' ' ' SER . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m -69.12 152.44 45.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.42 139.01 83.9 Favored Pre-proline 0 N--CA 1.44 -0.935 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -73.71 157.33 48.3 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.823 2.349 . . . . 0.0 115.181 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.367 23.6 mtm105 -92.48 165.67 12.92 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.078 -4.139 . . . . 0.0 108.267 -178.279 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.371 11.7 t -141.68 -161.31 1.2 Allowed 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 124.99 1.432 . . . . 0.0 114.656 -177.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.41 -147.55 19.23 Favored Glycine 0 N--CA 1.441 -0.98 0 C-N-CA 129.304 3.335 . . . . 0.0 109.754 173.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.259 18.8 mm -120.36 134.1 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 128.385 2.674 . . . . 0.0 109.674 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -66.06 128.76 94.03 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.904 2.482 . . . . 0.0 107.841 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.96 -21.53 14.03 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-O 113.387 -2.839 . . . . 0.0 118.737 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.371 86.4 mttt -94.59 -17.09 22.66 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.939 2.649 . . . . 0.0 113.828 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.377 1.4 t -152.18 163.51 39.24 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.798 1.639 . . . . 0.0 109.739 177.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -80.03 92.57 5.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 125.15 2.405 . . . . 0.0 107.765 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.298 12.8 pt20 -155.59 161.09 40.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 108.908 -3.769 . . . . 0.0 108.995 165.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -83.95 166.42 17.84 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.78 1.925 . . . . 0.0 109.199 172.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 76.1 mt -103.82 143.29 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 124.553 2.12 . . . . 0.0 105.617 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -144.23 102.7 3.9 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 108.477 -3.965 . . . . 0.0 103.279 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 12.3 pt -140.07 146.35 46.04 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 120.927 1.694 . . . . 0.0 108.856 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -72.2 154.2 56.8 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 125.243 3.962 . . . . 0.0 113.609 -175.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -113.77 -20.68 11.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.911 2.084 . . . . 0.0 110.051 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.02 -171.05 14.59 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.495 HG12 HD13 ' B' ' 42' ' ' LEU . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.413 ' HB3' ' HA2' ' B' ' 54' ' ' GLY . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LYS . . . . . 0.481 ' HA ' HG22 ' B' ' 92' ' ' THR . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' THR . . . . . 0.481 HG22 ' HA ' ' B' ' 89' ' ' LYS . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t -160.32 117.21 2.45 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -84.71 116.1 23.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.575 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.31 16.1 pttm . . . . . 0 C--O 1.246 0.869 0 O-C-N 125.885 1.99 . . . . 0.0 113.73 161.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ttt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 116.409 -1.758 . . . . 0.0 106.481 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.251 . . -88.3 -177.58 5.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.341 2.656 . . . . 0.0 109.823 -176.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -89.4 153.35 20.92 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 127.002 2.689 . . . . 0.0 110.025 169.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 4' ' ' ILE . 23.8 mt -117.06 119.14 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 159.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.446 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t -143.3 118.65 10.25 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 20.6 p -76.91 157.05 31.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 170.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -55.72 146.91 43.93 Favored Pre-proline 0 N--CA 1.448 -0.527 1 C-N-CA 132.536 4.334 . . . . 0.0 115.439 -174.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -81.57 152.8 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 167.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.284 35.1 mtm105 -121.37 161.27 22.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.5 3.12 . . . . 0.0 110.801 -175.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.34 13.3 t -144.02 101.52 3.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.871 2.869 . . . . 0.0 108.895 166.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.4 -173.05 14.5 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 126.347 1.927 . . . . 0.0 110.138 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.1 pt -106.95 160.39 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 O-C-N 116.701 -3.823 . . . . 0.0 103.688 -160.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -72.25 144.2 86.77 Favored Pre-proline 0 N--CA 1.444 -0.734 0 O-C-N 118.421 -2.674 . . . . 0.0 111.669 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -75.3 -12.54 20.94 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.697 2.931 . . . . 0.0 118.585 -169.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -151.67 -8.25 0.22 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 115.39 -2.243 . . . . 0.0 113.171 -171.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.353 53.5 p -134.14 152.13 51.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.04 2.536 . . . . 0.0 106.461 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -74.2 61.15 0.84 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.317 2.247 . . . . 0.0 115.368 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -133.0 163.8 28.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 128.278 2.631 . . . . 0.0 116.67 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.6 141.51 50.25 Favored 'General case' 0 N--CA 1.45 -0.435 1 C-N-CA 132.778 4.431 . . . . 0.0 106.358 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.9 mt -116.12 157.22 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.326 52.1 mm-40 -109.31 105.93 15.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 124.435 2.064 . . . . 0.0 106.133 159.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.3 mt -90.26 129.5 45.35 Favored Pre-proline 0 N--CA 1.452 -0.342 0 O-C-N 117.285 -3.384 . . . . 0.0 106.188 -173.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.11 165.67 32.09 Favored 'Trans proline' 0 N--CA 1.445 -1.351 0 C-N-CA 122.243 1.962 . . . . 0.0 114.673 -170.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.02 147.51 42.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.42 163.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.11 178.99 16.29 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 170.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.426 HD11 HG21 ' B' ' 95' ' ' VAL . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 90' ' ' ILE . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.587 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.587 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.504 HD21 HG13 ' B' ' 27' ' ' ILE . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.504 HG13 HD21 ' B' ' 13' ' ' LEU . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m -102.16 148.14 25.77 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -66.52 127.11 93.19 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-O 114.572 -2.632 . . . . 0.0 106.559 -167.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -69.01 166.19 27.54 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 O-C-N 128.306 3.793 . . . . 0.0 113.207 176.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.333 30.1 mtm180 -98.18 151.53 20.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 130.275 3.43 . . . . 0.0 106.204 171.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -119.67 -143.64 0.36 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.708 173.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.46 170.67 12.04 Favored Glycine 0 CA--C 1.527 0.836 1 C-N-CA 134.155 5.645 . . . . 0.0 110.11 -177.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 41.0 mm -109.63 148.64 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -83.93 131.13 52.47 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-O 116.336 -1.792 . . . . 0.0 108.398 176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -78.23 -21.47 10.49 Favored 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.855 5.036 . . . . 0.0 114.499 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.271 69.9 tttt -74.89 -30.49 61.32 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 129.744 3.218 . . . . 0.0 114.031 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.288 2.0 t -159.98 142.61 13.52 Favored 'General case' 0 N--CA 1.45 -0.441 1 N-CA-C 100.197 -4.001 . . . . 0.0 100.197 175.062 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -68.16 93.2 0.43 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.204 1.401 . . . . 0.0 109.369 -174.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -157.96 154.32 27.6 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.966 0.906 . . . . 0.0 110.498 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -87.02 139.93 30.07 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -171.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 10.4 mt -98.16 152.52 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 C-N-CA 126.629 1.971 . . . . 0.0 107.98 167.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -159.5 125.19 4.24 Favored 'General case' 0 CA--C 1.518 -0.278 1 CA-C-O 128.522 4.01 . . . . 0.0 104.135 173.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . 0.282 5.9 pt -139.7 140.07 23.84 Favored Pre-proline 0 C--O 1.237 0.436 0 C-N-CA 129.645 3.178 . . . . 0.0 114.962 -177.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -72.12 148.11 49.74 Favored 'Trans proline' 0 N--CA 1.447 -1.248 1 C-N-CA 127.415 5.41 . . . . 0.0 113.401 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.28 . . -113.85 -11.98 12.77 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.86 -164.2 12.11 Favored Glycine 0 C--N 1.33 0.222 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 83' ' ' ILE . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m -88.07 85.3 6.94 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -68.39 141.99 55.55 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 127.165 2.186 . . . . 0.0 107.022 148.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 24.4 pttt . . . . . 0 C--O 1.242 0.66 0 C-N-CA 128.331 2.652 . . . . 0.0 108.34 -174.307 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.6 ttp . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 113.893 -2.956 . . . . 0.0 105.929 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.06 150.84 35.28 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 123.319 2.782 . . . . 0.0 106.133 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -154.16 151.91 29.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 130.556 3.542 . . . . 0.0 108.934 174.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt -78.2 120.66 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 O-C-N 118.01 -2.931 . . . . 0.0 107.87 -172.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.528 ' HG2' HD13 ' A' ' 7' ' ' LEU . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' B' ' 22' ' ' ILE . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.499 HG21 ' HB3' ' B' ' 26' ' ' ASP . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t -115.16 169.86 8.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 78.9 p -128.68 105.38 8.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 129.083 2.953 . . . . 0.0 105.63 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.282 50.3 pttt -44.33 153.76 0.43 Allowed Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 131.108 3.763 . . . . 0.0 114.683 -165.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.05 163.4 30.86 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 O-C-N 123.333 1.175 . . . . 0.0 113.445 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 41.2 mtm105 -136.09 169.45 17.6 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.444 2.298 . . . . 0.0 111.514 -168.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.254 12.5 t -127.59 156.97 41.43 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 125.681 2.658 . . . . 0.0 109.863 168.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.18 -167.79 11.13 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 105.66 -2.976 . . . . 0.0 105.66 163.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.443 HD13 HG21 ' A' ' 67' ' ' ILE . 48.0 pt -125.71 159.74 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 124.34 1.056 . . . . 0.0 108.417 175.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -72.21 146.28 89.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.653 -2.351 . . . . 0.0 104.653 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -90.58 -7.04 4.16 Favored 'Trans proline' 0 N--CA 1.452 -0.919 1 C-N-CA 127.613 5.542 . . . . 0.0 116.154 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -132.65 9.02 4.24 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.174 -2.829 . . . . 0.0 115.641 -176.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.281 73.7 p -156.19 156.27 33.87 Favored 'General case' 0 N--CA 1.444 -0.769 1 C-N-CA 133.034 4.533 . . . . 0.0 108.112 173.995 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -83.15 45.29 1.01 Allowed 'General case' 0 N--CA 1.451 -0.406 2 O-C-N 115.614 -4.429 . . . . 0.0 115.037 173.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -107.24 133.34 51.96 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 130.214 3.405 . . . . 0.0 112.414 -174.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE 0.329 27.8 tttt -79.29 159.83 27.07 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 125.455 1.722 . . . . 0.0 110.13 -172.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' LYS . 11.2 mm -133.17 130.18 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 O-C-N 120.419 -1.425 . . . . 0.0 110.228 176.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.283 7.8 mm100 -95.52 125.43 40.12 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.354 -3.213 . . . . 0.0 106.083 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mt -110.07 140.42 22.34 Favored Pre-proline 0 N--CA 1.446 -0.667 0 O-C-N 128.691 3.744 . . . . 0.0 104.142 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -79.48 158.79 25.68 Favored 'Trans proline' 0 N--CA 1.443 -1.476 0 O-C-N 125.845 2.498 . . . . 0.0 115.868 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.17 164.54 12.98 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 116.682 -2.007 . . . . 0.0 113.689 158.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -126.35 174.83 17.9 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 128.36 3.537 . . . . 0.0 108.352 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 85' ' ' LEU . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.482 HG23 HG22 ' A' ' 30' ' ' VAL 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.499 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.437 ' CG1' HD22 ' B' ' 34' ' ' LEU . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.437 HD22 ' CG1' ' B' ' 30' ' ' VAL . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' B' ' 42' ' ' LEU . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' B' ' 39' ' ' ALA . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.43 HG22 HD11 ' A' ' 7' ' ' LEU . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m -86.29 144.27 27.48 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.276 64.6 tttt -53.1 100.2 0.22 Allowed Pre-proline 0 N--CA 1.448 -0.557 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.38 165.7 31.65 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 125.292 3.995 . . . . 0.0 113.378 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 25.9 mtm105 -98.47 156.72 16.63 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.261 1.3 t -134.63 131.57 37.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.778 2.431 . . . . 0.0 109.846 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -133.86 -179.51 16.46 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 127.205 2.336 . . . . 0.0 109.862 169.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 17.5 mm -118.69 132.31 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 C-N-CA 127.761 2.424 . . . . 0.0 108.592 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -80.39 127.03 77.42 Favored Pre-proline 0 N--CA 1.45 -0.448 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -78.13 -17.3 13.52 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.252 2.635 . . . . 0.0 112.761 -175.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -112.11 -10.55 13.88 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 126.0 1.72 . . . . 0.0 113.593 -164.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.8 t -149.03 176.6 10.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -93.33 30.74 1.62 Allowed 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.761 3.225 . . . . 0.0 113.981 -156.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -118.5 151.36 37.99 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 129.084 2.954 . . . . 0.0 114.493 -160.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -93.97 145.69 24.47 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.987 1.715 . . . . 0.0 109.816 165.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 68.0 mt -111.99 133.46 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 100.944 -3.725 . . . . 0.0 100.944 177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.01 133.01 55.15 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.345 -1.312 . . . . 0.0 108.525 168.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.61 123.66 31.04 Favored Pre-proline 0 N--CA 1.452 -0.326 0 O-C-N 127.006 2.692 . . . . 0.0 105.893 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -76.28 160.27 36.05 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.597 4.198 . . . . 0.0 112.613 -169.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.347 . . -113.97 -33.3 5.78 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 130.319 3.448 . . . . 0.0 109.943 174.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 120.58 -155.27 16.26 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 157.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' LEU 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t -153.32 92.11 1.57 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -70.28 132.0 45.03 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 128.818 2.847 . . . . 0.0 107.889 177.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 17.1 mttp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 128.121 2.569 . . . . 0.0 110.265 169.84 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.6 ttm . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.19 112.08 12.28 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.91 1.684 . . . . 0.0 107.012 174.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -117.44 130.12 56.27 Favored 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 118.84 -2.412 . . . . 0.0 109.903 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp -80.97 141.99 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 131.641 3.977 . . . . 0.0 104.336 -177.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t -136.0 124.34 23.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.0 p -88.5 118.5 28.19 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 125.168 2.413 . . . . 0.0 106.153 163.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -50.33 162.89 0.48 Allowed Pre-proline 0 N--CA 1.442 -0.855 1 O-C-N 115.225 -4.672 . . . . 0.0 115.058 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -75.99 149.71 33.12 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 CA-C-O 117.379 -1.175 . . . . 0.0 109.54 163.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -142.34 176.51 8.94 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 126.631 1.973 . . . . 0.0 110.055 173.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.305 7.9 t -135.29 125.22 25.72 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 128.613 2.765 . . . . 0.0 110.733 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.95 -168.7 16.54 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 106.493 -2.643 . . . . 0.0 106.493 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 pt -132.41 148.03 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 1 C-N-CA 133.792 4.837 . . . . 0.0 107.227 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -57.46 133.28 81.8 Favored Pre-proline 0 N--CA 1.445 -0.675 0 O-C-N 127.109 2.756 . . . . 0.0 115.516 158.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.64 -20.73 9.1 Favored 'Trans proline' 0 N--CA 1.446 -1.277 0 O-C-N 116.383 -2.482 . . . . 0.0 115.575 -172.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -102.06 -17.01 16.25 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 121.854 2.116 . . . . 0.0 116.175 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 51.1 p -134.63 159.33 41.56 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.088 2.155 . . . . 0.0 109.528 176.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -86.04 103.92 15.17 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.936 -2.246 . . . . 0.0 104.936 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -158.2 128.29 6.06 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 103.547 -2.76 . . . . 0.0 103.547 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -84.5 133.42 34.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 23.0 mm -124.74 120.8 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 126.837 2.055 . . . . 0.0 105.912 -177.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.314 44.3 mm-40 -85.93 141.9 29.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.392 -2.693 . . . . 0.0 111.428 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 63.3 mt -106.41 115.62 60.53 Favored Pre-proline 0 N--CA 1.439 -0.986 0 C-N-CA 126.516 1.926 . . . . 0.0 107.851 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.83 162.7 32.15 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.376 3.384 . . . . 0.0 112.065 -168.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.53 132.11 45.02 Favored 'General case' 0 N--CA 1.451 -0.389 1 O-C-N 129.6 4.313 . . . . 0.0 108.252 174.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.48 157.3 20.83 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 127.393 2.425 . . . . 0.0 115.011 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.417 ' ND1' ' HG2' ' B' ' 81' ' ' LYS . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.443 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' THR . . . . . 0.436 ' HA ' HE22 ' B' ' 35' ' ' GLN . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.436 HE22 ' HA ' ' B' ' 32' ' ' THR 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -80.14 135.55 36.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.402 12.1 tttt -41.44 119.31 1.89 Allowed Pre-proline 0 CA--C 1.513 -0.459 0 C-N-CA 128.671 2.788 . . . . 0.0 117.614 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -78.64 175.84 10.56 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 124.841 3.694 . . . . 0.0 110.812 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -100.2 159.89 14.76 Favored 'General case' 0 C--N 1.328 -0.347 1 C-N-CA 132.022 4.129 . . . . 0.0 107.717 159.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -145.59 128.24 16.17 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 -167.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -131.59 -173.04 13.23 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 119.656 -1.259 . . . . 0.0 112.764 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -119.54 142.58 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.185 2.194 . . . . 0.0 112.249 173.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -74.46 136.46 74.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 103.498 -2.779 . . . . 0.0 103.498 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -83.86 3.05 7.9 Favored 'Trans proline' 0 N--CA 1.447 -1.224 1 C-N-CA 125.543 4.162 . . . . 0.0 111.472 174.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 27.7 tptt -122.52 -16.04 7.39 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 121.376 1.898 . . . . 0.0 113.158 -168.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 3.9 t -160.83 160.37 31.05 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.591 3.557 . . . . 0.0 107.93 -167.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -89.94 49.19 1.68 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.147 2.179 . . . . 0.0 108.277 -174.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -113.92 156.98 23.02 Favored 'General case' 0 N--CA 1.451 -0.421 1 C-N-CA 133.993 4.917 . . . . 0.0 109.427 169.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -80.44 171.75 14.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 129.101 2.96 . . . . 0.0 107.653 168.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 96.6 mt -129.93 129.14 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 101.677 -3.453 . . . . 0.0 101.677 159.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -103.42 135.99 44.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 104.869 -2.271 . . . . 0.0 104.869 179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.19 98.08 42.24 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 128.242 2.617 . . . . 0.0 112.907 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.42 164.1 36.63 Favored 'Trans proline' 0 N--CA 1.451 -0.974 1 C-N-CA 126.276 4.651 . . . . 0.0 111.433 -170.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -114.35 -48.05 2.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -178.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 133.57 -147.33 18.99 Favored Glycine 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HG2' ' ND1' ' A' ' 98' ' ' HIS . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t -155.15 94.23 1.6 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -66.13 136.64 56.23 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.92 1.288 . . . . 0.0 111.74 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' B' ' 99' ' ' LYS . 9.0 ptpt . . . . . 0 C--O 1.258 1.535 0 C-N-CA 129.494 3.118 . . . . 0.0 107.202 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 121.668 0.747 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.24 79.65 7.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 125.941 2.781 . . . . 0.0 110.958 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -84.26 149.72 25.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.377 -2.647 . . . . 0.0 105.848 172.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm -84.83 130.55 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 129.212 3.005 . . . . 0.0 110.093 169.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.415 HD13 ' HG3' ' B' ' 41' ' ' GLU . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.57 HG22 HG23 ' B' ' 22' ' ' ILE . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HB3' HD12 ' A' ' 53' ' ' ILE . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.587 HD12 ' HB3' ' A' ' 50' ' ' LEU . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t -145.4 175.51 10.26 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.0 p -123.97 173.74 8.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 127.221 2.208 . . . . 0.0 110.642 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.3 pttt -84.33 158.67 60.4 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 114.569 -2.634 . . . . 0.0 112.937 167.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.0 149.85 53.61 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 CA-C-N 124.281 2.564 . . . . 0.0 112.283 171.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.315 34.8 mtm105 -137.89 169.15 18.28 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.321 3.048 . . . . 0.0 110.564 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.345 2.8 t -151.76 148.32 27.74 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.543 1.937 . . . . 0.0 105.94 -178.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.31 -177.2 15.71 Favored Glycine 0 N--CA 1.447 -0.577 1 C-N-CA 132.409 4.814 . . . . 0.0 108.32 -175.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.267 1.5 pp -120.36 152.99 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 C-N-CA 126.125 1.77 . . . . 0.0 107.044 173.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.3 133.16 39.2 Favored Pre-proline 0 N--CA 1.439 -1.025 0 C-N-CA 130.256 3.423 . . . . 0.0 102.018 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.78 -17.86 5.82 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 N-CA-C 117.834 2.206 . . . . 0.0 117.834 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -93.02 -27.31 17.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.092 1.757 . . . . 0.0 112.523 -171.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 69.9 p -146.65 173.96 11.88 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 126.66 1.984 . . . . 0.0 107.823 176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -87.19 72.22 9.96 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.979 0.912 . . . . 0.0 108.621 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -126.99 166.45 17.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 131.325 3.85 . . . . 0.0 110.134 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -102.92 160.21 14.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.89 2.476 . . . . 0.0 113.12 164.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.6 mm -115.57 136.27 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 O-C-N 127.344 2.903 . . . . 0.0 103.526 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -98.19 134.81 40.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.612 . . . . 0.0 108.612 170.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.4 mt -125.31 101.12 31.64 Favored Pre-proline 0 N--CA 1.448 -0.558 0 N-CA-C 102.993 -2.965 . . . . 0.0 102.993 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -82.82 170.63 12.47 Favored 'Trans proline' 0 N--CA 1.451 -0.995 1 C-N-CA 127.333 5.356 . . . . 0.0 108.703 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -102.94 147.27 27.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 169.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.27 137.22 12.84 Favored Glycine 0 CA--C 1.528 0.85 1 C-N-CA 134.454 5.788 . . . . 0.0 113.379 170.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.57 HG23 HG22 ' A' ' 30' ' ' VAL . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG3' HD13 ' A' ' 7' ' ' LEU . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m -98.23 137.01 37.61 Favored 'General case' 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -62.47 129.7 92.78 Favored Pre-proline 0 N--CA 1.449 -0.481 0 C-N-CA 129.357 3.063 . . . . 0.0 107.683 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -84.48 177.7 5.54 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 O-C-N 123.007 1.004 . . . . 0.0 114.512 -178.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -124.26 166.16 16.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 128.856 2.862 . . . . 0.0 107.009 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.313 2.7 t -140.66 162.91 34.26 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.74 172.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.88 170.91 22.63 Favored Glycine 0 N--CA 1.443 -0.866 0 O-C-N 128.453 3.596 . . . . 0.0 106.946 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.92 146.92 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 C-N-CA 130.291 3.437 . . . . 0.0 105.46 165.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -82.86 133.78 48.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 O-C-N 125.261 1.601 . . . . 0.0 107.032 177.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -84.23 -18.96 4.82 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 CA-C-N 123.757 2.377 . . . . 0.0 112.63 -176.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -87.19 -29.57 21.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.074 2.734 . . . . 0.0 108.502 -171.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.5 t -136.61 160.63 38.24 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.345 2.258 . . . . 0.0 111.408 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -79.26 78.36 5.75 Favored 'General case' 0 C--O 1.237 0.416 2 C-N-CA 131.878 4.071 . . . . 0.0 106.714 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -138.61 167.14 22.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.346 3.458 . . . . 0.0 111.728 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -114.25 159.5 20.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.09 -2.256 . . . . 0.0 110.353 -169.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -136.77 133.41 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.618 3.567 . . . . 0.0 101.496 -167.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.25 67.4 mm-40 -106.94 137.57 44.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 169.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 85.1 mt -127.8 109.65 20.41 Favored Pre-proline 0 N--CA 1.446 -0.627 0 O-C-N 125.945 2.028 . . . . 0.0 108.337 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.38 146.99 25.24 Favored 'Trans proline' 0 N--CA 1.439 -1.693 0 C-N-CA 122.774 2.316 . . . . 0.0 106.959 177.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.287 . . -103.68 -38.86 6.92 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 142.72 -174.96 23.27 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 170.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.2 136.19 3.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -65.24 125.65 25.68 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.518 3.056 . . . . 0.0 112.076 169.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? . . . . . 0 C--O 1.25 1.106 0 O-C-N 116.378 -3.951 . . . . 0.0 104.981 -175.013 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 ttp . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 117.3 -1.333 . . . . 0.0 111.575 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.43 146.47 26.95 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.46 1.027 . . . . 0.0 110.749 174.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -90.85 99.13 12.22 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.492 2.995 . . . . 0.0 104.375 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm -101.81 130.92 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HE2' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 33.7 tp60 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 27' ' ' ILE 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.414 HG23 ' CD2' ' B' ' 51' ' ' PHE . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' HG3' ' B' ' 11' ' ' GLU . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' H ' ' A' ' 50' ' ' LEU 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t -150.0 139.28 21.31 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 69.1 p -97.08 141.24 30.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 126.848 2.059 . . . . 0.0 108.175 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -68.49 155.31 93.0 Favored Pre-proline 0 C--O 1.225 -0.225 0 CA-C-N 124.047 3.112 . . . . 0.0 112.107 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.01 159.23 30.66 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 116.916 -1.589 . . . . 0.0 111.547 174.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.25 40.7 mtm105 -130.2 163.98 25.51 Favored 'General case' 0 N--CA 1.451 -0.407 1 O-C-N 132.179 5.924 . . . . 0.0 107.116 -177.54 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -149.96 145.77 26.65 Favored 'General case' 0 N--CA 1.449 -0.518 2 C-N-CA 134.408 5.083 . . . . 0.0 116.07 168.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.49 166.85 25.72 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 104.63 -3.388 . . . . 0.0 104.63 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.2 pt -104.6 155.69 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 126.909 2.084 . . . . 0.0 110.962 167.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.88 132.0 37.74 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 103.111 -2.922 . . . . 0.0 103.111 -175.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.86 -20.55 22.29 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 CA-C-O 114.809 -2.246 . . . . 0.0 111.907 -174.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.22 -29.06 14.24 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 129.413 3.085 . . . . 0.0 112.965 -171.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.9 p -148.36 157.67 43.63 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.433 3.493 . . . . 0.0 113.347 -165.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -72.6 69.89 0.9 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 124.712 2.196 . . . . 0.0 113.307 172.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -133.08 108.87 9.12 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 119.144 -2.222 . . . . 0.0 107.96 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -92.05 133.47 35.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 26.2 mm -110.36 132.44 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 O-C-N 119.478 -2.014 . . . . 0.0 106.802 -172.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -105.52 130.34 53.61 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 130.24 3.416 . . . . 0.0 105.292 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 5.4 mt -116.8 99.09 52.7 Favored Pre-proline 0 N--CA 1.451 -0.405 0 C-N-CA 127.135 2.174 . . . . 0.0 108.045 170.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -84.18 172.36 9.63 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-N 120.354 1.162 . . . . 0.0 114.061 -174.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.99 140.1 45.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 122.34 1.067 . . . . 0.0 113.473 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.68 142.04 16.27 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 129.615 3.483 . . . . 0.0 110.148 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.44 HD12 HG11 ' B' ' 87' ' ' VAL . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' LYS 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 37' ' ' VAL . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' PHE . . . . . 0.414 ' CD2' HG23 ' A' ' 32' ' ' THR . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' PHE . . . . . 0.404 ' CZ ' HD13 ' B' ' 85' ' ' LEU . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m -107.61 136.95 46.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -63.26 125.12 86.38 Favored Pre-proline 0 CA--C 1.514 -0.409 0 C-N-CA 129.864 3.266 . . . . 0.0 111.831 -176.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' PRO . . . . . 0.402 ' HB3' ' HA ' ' B' ' 78' ' ' PRO . 5.5 Cg_endo -61.33 164.2 15.65 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 O-C-N 125.861 2.506 . . . . 0.0 115.461 176.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -97.25 163.08 13.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 128.073 2.549 . . . . 0.0 110.857 156.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.388 12.9 t -149.14 138.14 21.35 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.068 3.347 . . . . 0.0 110.299 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.19 -176.66 14.47 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 117.005 -1.997 . . . . 0.0 113.731 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.3 mm -112.48 147.01 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.786 3.293 . . . . 0.0 107.294 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -72.96 133.17 82.12 Favored Pre-proline 0 N--CA 1.445 -0.684 0 C-N-CA 129.182 2.993 . . . . 0.0 109.318 169.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.73 -42.02 1.92 Allowed 'Trans proline' 0 N--CA 1.439 -1.7 0 O-C-N 124.825 1.961 . . . . 0.0 115.435 177.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -79.74 -18.77 50.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.873 3.269 . . . . 0.0 115.481 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 2.5 t -157.24 156.74 33.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.408 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -67.42 101.28 0.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 125.698 1.874 . . . . 0.0 107.126 170.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -172.03 138.72 1.04 Allowed 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.208 2.603 . . . . 0.0 113.497 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -92.41 138.91 31.11 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.551 1.167 . . . . 0.0 108.551 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.8 mt -94.81 145.53 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-O 113.601 -3.095 . . . . 0.0 108.818 166.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -119.76 126.96 52.3 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.783 2.552 . . . . 0.0 105.331 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.0 mt -127.68 121.5 22.18 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-N 121.868 2.122 . . . . 0.0 108.903 -174.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 63' ' ' PRO . 56.8 Cg_endo -84.0 172.91 9.46 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 CA-C-N 123.937 2.442 . . . . 0.0 115.553 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -134.75 14.59 3.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 118.569 2.803 . . . . 0.0 118.569 178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 98.6 -176.23 29.77 Favored Glycine 0 CA--C 1.525 0.71 0 O-C-N 119.045 -2.284 . . . . 0.0 117.85 167.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD13 ' CZ ' ' B' ' 56' ' ' PHE 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.44 HG11 HD12 ' A' ' 83' ' ' ILE . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t -169.21 113.67 0.55 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -81.94 116.94 21.8 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 124.857 2.265 . . . . 0.0 108.199 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.331 0.1 OUTLIER . . . . . 0 C--O 1.247 0.951 0 CA-C-O 114.92 -2.467 . . . . 0.0 110.463 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 mtt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 125.82 2.724 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.42 163.06 12.54 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 125.303 2.477 . . . . 0.0 112.079 175.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -109.24 103.74 12.76 Favored 'General case' 0 N--CA 1.453 -0.29 1 O-C-N 115.629 -4.419 . . . . 0.0 102.39 169.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt -95.14 127.22 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 7' ' ' LEU . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.1 tp60 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.424 ' CB ' HD11 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HD22 ' A' ' 58' ' ' LEU 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 HG23 ' A' ' 45' ' ' THR . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t -142.72 134.5 26.81 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.2 p -107.53 128.17 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 127.472 2.309 . . . . 0.0 106.588 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.6 pttt -72.82 163.27 69.48 Favored Pre-proline 0 N--CA 1.45 -0.465 0 C-N-CA 125.854 1.662 . . . . 0.0 112.948 168.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.39 170.82 16.42 Favored 'Trans proline' 0 N--CA 1.442 -1.523 1 C-N-CA 125.618 4.212 . . . . 0.0 118.183 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 59.6 mtm180 -153.39 169.68 22.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.673 2.789 . . . . 0.0 113.632 -170.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.281 3.6 t -138.91 138.44 37.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 125.041 1.463 . . . . 0.0 110.788 163.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.69 160.54 13.09 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 106.044 -2.822 . . . . 0.0 106.044 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -97.48 159.63 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 124.924 2.297 . . . . 0.0 108.666 170.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -77.4 133.32 67.9 Favored Pre-proline 0 N--CA 1.443 -0.823 1 C-N-CA 136.583 5.953 . . . . 0.0 107.066 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -84.14 -18.34 5.21 Favored 'Trans proline' 0 N--CA 1.447 -1.264 0 C-N-CA 125.294 3.996 . . . . 0.0 117.599 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -96.8 -34.0 11.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.644 1.578 . . . . 0.0 110.003 -173.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.5 p -135.41 175.56 9.48 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 122.062 2.21 . . . . 0.0 107.862 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -76.22 68.94 2.7 Favored 'General case' 0 N--CA 1.451 -0.423 1 O-C-N 114.542 -5.098 . . . . 0.0 111.812 159.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -128.36 -174.78 3.32 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 117.529 -3.232 . . . . 0.0 107.78 170.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -149.49 156.91 42.75 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.083 -172.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.452 HD12 ' N ' ' A' ' 75' ' ' ILE . 4.5 mp -115.96 128.4 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 116.757 -1.592 . . . . 0.0 107.781 178.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -85.2 123.88 31.21 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.299 -2.286 . . . . 0.0 105.037 169.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 85.4 mt -102.72 122.17 46.91 Favored Pre-proline 0 N--CA 1.447 -0.596 0 N-CA-C 103.313 -2.847 . . . . 0.0 103.313 -174.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.44 165.26 20.92 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-O 125.256 2.107 . . . . 0.0 111.439 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.58 150.86 42.74 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 109.113 -3.676 . . . . 0.0 110.337 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -113.5 161.92 12.54 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 129.283 3.325 . . . . 0.0 106.161 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.424 HD11 ' CB ' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m -98.06 153.98 18.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -60.24 123.15 71.65 Favored Pre-proline 0 N--CA 1.447 -0.577 0 C-N-CA 126.097 1.759 . . . . 0.0 109.145 176.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.74 159.88 49.58 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 CA-C-N 123.542 2.301 . . . . 0.0 115.287 168.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -103.83 166.28 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.108 3.763 . . . . 0.0 115.26 172.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.259 9.2 t -141.81 143.08 33.24 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 125.457 2.551 . . . . 0.0 107.918 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.51 -176.69 15.34 Favored Glycine 0 CA--C 1.527 0.838 0 CA-C-N 110.835 -2.893 . . . . 0.0 112.378 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.2 mm -129.06 132.67 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.53 131.6 94.88 Favored Pre-proline 0 N--CA 1.449 -0.517 0 O-C-N 116.908 -3.62 . . . . 0.0 114.761 156.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -82.96 -7.84 11.15 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 N-CA-C 121.341 3.554 . . . . 0.0 121.341 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -92.39 -23.46 19.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 116.782 -1.58 . . . . 0.0 112.321 -170.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.9 t -149.72 141.36 23.52 Favored 'General case' 0 N--CA 1.444 -0.743 1 N-CA-C 98.683 -4.562 . . . . 0.0 98.683 164.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -77.32 85.14 3.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pt20 -131.9 142.81 49.77 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 126.5 1.92 . . . . 0.0 110.445 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -85.17 125.82 33.14 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.36 2.264 . . . . 0.0 111.235 -163.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mt -84.04 157.69 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 125.929 1.692 . . . . 0.0 106.466 171.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -122.39 130.03 52.69 Favored 'General case' 0 N--CA 1.445 -0.687 1 N-CA-C 99.021 -4.437 . . . . 0.0 99.021 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.7 mt -135.68 123.05 14.82 Favored Pre-proline 0 N--CA 1.445 -0.711 1 O-C-N 129.9 4.5 . . . . 0.0 104.692 -169.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.86 167.0 28.42 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.075 1.183 . . . . 0.0 113.403 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -142.33 -19.36 0.7 Allowed 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.827 3.251 . . . . 0.0 113.29 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.75 -159.63 18.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 158.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' B' ' 91' ' ' LEU . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t -131.66 107.01 8.52 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.0 t60 -87.3 140.93 29.04 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 126.285 2.945 . . . . 0.0 104.079 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.374 0 O-C-N 116.753 -3.717 . . . . 0.0 112.092 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ttt . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 111.909 -3.9 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.77 84.27 0.89 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 101.483 -3.525 . . . . 0.0 101.483 169.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -83.75 65.62 8.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.427 1.891 . . . . 0.0 105.936 171.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt -129.51 131.09 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 -161.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 31' ' ' VAL . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.418 HG22 HG12 ' B' ' 22' ' ' ILE . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 27' ' ' ILE . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.414 HD21 ' HB3' ' A' ' 56' ' ' PHE . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.414 ' HB3' HD21 ' A' ' 42' ' ' LEU 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t -153.06 140.95 20.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.5 p -122.37 138.73 54.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 129.598 3.159 . . . . 0.0 109.115 166.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -88.81 154.41 50.19 Favored Pre-proline 0 N--CA 1.45 -0.431 0 C-N-CA 127.591 2.356 . . . . 0.0 111.938 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.323 50.9 Cg_endo -66.93 164.71 28.71 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 N-CA-C 119.766 2.948 . . . . 0.0 119.766 -170.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -130.17 136.28 49.08 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 127.674 2.39 . . . . 0.0 110.144 175.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.2 t -141.3 -174.23 3.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.46 -147.39 16.56 Favored Glycine 0 C--N 1.337 0.597 0 O-C-N 118.855 -2.403 . . . . 0.0 111.629 178.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.2 pt -132.27 140.33 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.54 128.69 88.61 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 114.836 -2.507 . . . . 0.0 109.799 163.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -74.16 -28.06 11.14 Favored 'Trans proline' 0 N--CA 1.444 -1.408 0 O-C-N 127.191 3.206 . . . . 0.0 116.79 -175.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -94.0 -30.46 14.71 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.222 3.009 . . . . 0.0 108.086 -166.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.7 p -143.28 159.71 41.84 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 125.596 1.81 . . . . 0.0 109.186 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -69.84 91.75 0.66 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.349 1.86 . . . . 0.0 112.964 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -159.41 131.87 6.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.78 2.832 . . . . 0.0 107.625 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -43.79 141.63 1.51 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 157.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.3 mt -105.15 132.65 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 100.873 -3.751 . . . . 0.0 100.873 161.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -147.98 77.58 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 -178.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.4 mt -92.96 127.57 46.95 Favored Pre-proline 0 CA--C 1.513 -0.453 0 N-CA-C 102.915 -2.995 . . . . 0.0 102.915 172.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -87.23 172.02 6.28 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 O-C-N 125.414 2.27 . . . . 0.0 109.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -53.69 151.15 6.41 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 128.516 2.726 . . . . 0.0 111.304 171.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -139.78 124.47 2.72 Favored Glycine 0 C--N 1.337 0.593 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.479 ' OG ' HG22 ' A' ' 90' ' ' ILE . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.479 HG22 ' OG ' ' A' ' 88' ' ' SER 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 30' ' ' VAL . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 44' ' ' THR . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' THR . . . . . 0.425 HG22 ' HA ' ' B' ' 41' ' ' GLU 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.446 HG23 ' HE3' ' B' ' 82' ' ' LYS . 6.6 m -89.55 137.34 32.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -44.05 125.06 4.31 Favored Pre-proline 0 N--CA 1.445 -0.683 0 C-N-CA 128.938 2.895 . . . . 0.0 110.757 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.48 141.16 83.04 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 123.667 2.911 . . . . 0.0 116.964 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -85.69 167.32 15.4 Favored 'General case' 0 N--CA 1.451 -0.383 1 O-C-N 129.411 4.195 . . . . 0.0 105.538 166.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.1 t -132.5 137.48 47.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.16 1.933 . . . . 0.0 113.972 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.49 -171.21 15.47 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 113.119 -1.855 . . . . 0.0 112.179 169.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.4 mm -110.41 137.12 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 102.509 -3.145 . . . . 0.0 102.509 161.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -50.49 129.72 25.94 Favored Pre-proline 0 N--CA 1.444 -0.774 0 C-N-CA 131.218 3.807 . . . . 0.0 112.167 167.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.8 -34.13 50.93 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 124.931 3.754 . . . . 0.0 121.061 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -90.71 -21.99 21.33 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.126 2.87 . . . . 0.0 115.553 -167.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 9.2 t -157.71 157.13 32.9 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 118.881 -2.387 . . . . 0.0 107.218 -170.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -82.61 83.37 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 117.738 -3.101 . . . . 0.0 110.285 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -138.76 156.48 47.33 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.991 2.516 . . . . 0.0 109.313 -174.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -81.67 143.25 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 114.875 -2.488 . . . . 0.0 111.538 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 2.1 mt -98.88 137.42 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 127.188 2.195 . . . . 0.0 106.753 165.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -98.99 101.19 12.49 Favored 'General case' 0 C--N 1.324 -0.538 1 C-N-CA 133.07 4.548 . . . . 0.0 109.336 154.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 25.9 mt -100.88 122.92 47.28 Favored Pre-proline 0 CA--C 1.515 -0.389 0 C-N-CA 127.349 2.26 . . . . 0.0 106.323 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -70.27 151.95 66.4 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.799 2.333 . . . . 0.0 112.826 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -121.62 -5.13 9.23 Favored 'General case' 0 CA--C 1.513 -0.452 0 O-C-N 126.342 2.277 . . . . 0.0 111.838 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.18 -165.07 25.01 Favored Glycine 0 C--N 1.341 0.841 0 C-N-CA 126.973 2.225 . . . . 0.0 113.584 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.446 ' HE3' HG23 ' B' ' 61' ' ' THR . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p -137.77 148.76 45.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 28.0 t60 -76.77 100.81 5.59 Favored 'General case' 0 N--CA 1.44 -0.959 0 O-C-N 124.898 1.374 . . . . 0.0 110.952 -170.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 82.5 mttt . . . . . 0 C--O 1.251 1.145 0 O-C-N 119.356 -2.09 . . . . 0.0 111.139 -170.737 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.648 HG13 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.648 ' H ' HG13 ' A' ' 24' ' ' VAL 0.259 16.3 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.456 ' HA ' HG22 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' B' ' 34' ' ' LEU . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.462 HG23 ' HA ' ' B' ' 82' ' ' LYS . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.494 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 12' ' ' TYR . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' A' ' 34' ' ' LEU . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.432 ' HA ' HG22 ' B' ' 44' ' ' THR . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . 0.432 HG22 ' HA ' ' B' ' 41' ' ' GLU . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.462 ' HA ' HG23 ' A' ' 92' ' ' THR . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 103.718 -2.697 . . . . 0.0 103.718 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 27' ' ' ILE . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD21 HG22 ' B' ' 31' ' ' VAL . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' HD2' ' B' ' 3' ' ' LYS . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 45' ' ' THR . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 44' ' ' THR 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' B' ' 5' ' ' LYS . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 53' ' ' ILE . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t . . . . . 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.442 0 CA-C-O 118.527 -1.152 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . 0.51 ' HD2' ' HG2' ' A' ' 41' ' ' GLU . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.426 ' HG3' HD22 ' A' ' 50' ' ' LEU . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.408 ' O ' HG22 ' B' ' 32' ' ' THR . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.742 HG22 HD21 ' A' ' 34' ' ' LEU . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . 0.408 HG22 ' O ' ' B' ' 28' ' ' ARG . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m . . . . . 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 115.423 0.929 . . . . 0.0 115.423 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.638 HG11 HG21 ' B' ' 30' ' ' VAL . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.454 HD22 HD12 ' A' ' 83' ' ' ILE . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.447 HD22 ' HG3' ' B' ' 5' ' ' LYS . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 HD22 ' A' ' 42' ' ' LEU . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.501 HG11 HD12 ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 93' ' ' ASP . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 91' ' ' LEU . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HG ' HG23 ' A' ' 90' ' ' ILE . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 89' ' ' LYS . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.447 ' HG3' HD22 ' A' ' 50' ' ' LEU . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.517 HD13 HG21 ' B' ' 22' ' ' ILE . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.638 HG21 HG11 ' A' ' 30' ' ' VAL . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . 0.453 ' CG2' HG23 ' B' ' 60' ' ' THR 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . 0.453 HG23 ' CG2' ' B' ' 45' ' ' THR . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 120.573 2.989 . . . . 0.0 120.573 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.438 HD12 ' N ' ' A' ' 27' ' ' ILE . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.489 ' N ' HD12 ' B' ' 22' ' ' ILE . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.71 HD21 HG23 ' B' ' 48' ' ' VAL . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.71 HG23 HD21 ' B' ' 42' ' ' LEU . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m . . . . . 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.695 0 N-CA-C 108.972 -1.651 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t . . . . . 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt . . . . . 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.418 ' HB3' HD11 ' B' ' 22' ' ' ILE . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 27' ' ' ILE . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.571 HG21 ' HD1' ' B' ' 12' ' ' TYR . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.621 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.509 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.571 ' HD1' HG21 ' A' ' 37' ' ' VAL . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 29' ' ' LEU . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 34' ' ' LEU . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.602 HD21 ' HD2' ' B' ' 81' ' ' LYS 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . 0.602 ' HD2' HD21 ' B' ' 58' ' ' LEU . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.448 ' H ' HG13 ' B' ' 83' ' ' ILE . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.631 HD12 ' H ' ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 116.016 -1.945 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.907 HG23 HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.537 ' O ' HG22 ' A' ' 92' ' ' THR . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.907 HG21 HG23 ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m . . . . . 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . 0.616 HD12 ' H ' ' B' ' 90' ' ' ILE . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt . . . . . 0 N--CA 1.446 -0.675 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB3' HD11 ' B' ' 22' ' ' ILE . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.742 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' B' ' 53' ' ' ILE . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.403 ' HB3' ' HA ' ' B' ' 2' ' ' ALA . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.443 HG21 HD23 ' A' ' 38' ' ' LEU . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.739 0 CA-C-O 119.061 -0.855 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' A' ' 56' ' ' PHE . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 47' ' ' GLU . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' B' ' 7' ' ' LEU . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.415 HD11 ' HB3' ' A' ' 29' ' ' LEU . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . 0.419 HD22 HG11 ' B' ' 48' ' ' VAL . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 HD22 ' B' ' 38' ' ' LEU . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.471 HD12 ' HB3' ' A' ' 38' ' ' LEU . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.8 0 CA-C-O 120.098 -0.279 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' B' ' 53' ' ' ILE . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 25' ' ' GLN . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD21 ' B' ' 34' ' ' LEU . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.417 HD21 HG11 ' A' ' 48' ' ' VAL . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.46 HD21 ' HB3' ' A' ' 56' ' ' PHE . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.417 HG11 HD21 ' A' ' 38' ' ' LEU . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 53' ' ' ILE . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB3' HD21 ' A' ' 42' ' ' LEU . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t . . . . . 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.797 0 N-CA-C 107.708 -2.157 . . . . 0.0 107.708 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.426 ' CB ' HD11 ' B' ' 83' ' ' ILE . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' B' ' 21' ' ' ASN 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.47 ' HB3' ' HB3' ' B' ' 18' ' ' ASP . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 31' ' ' VAL . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' B' ' 39' ' ' ALA . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.495 HD13 HG12 ' B' ' 83' ' ' ILE . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.425 HG23 HD21 ' B' ' 42' ' ' LEU . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA2' ' HB3' ' B' ' 88' ' ' SER . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.167 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.495 HG12 HD13 ' B' ' 42' ' ' LEU . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.413 ' HB3' ' HA2' ' B' ' 54' ' ' GLY . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . 0.481 ' HA ' HG22 ' B' ' 92' ' ' THR . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . 0.481 HG22 ' HA ' ' B' ' 89' ' ' LYS . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 4' ' ' ILE . 23.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.446 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t . . . . . 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.34 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.426 HD11 HG21 ' B' ' 95' ' ' VAL . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 90' ' ' ILE . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.587 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.587 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.504 HD21 HG13 ' B' ' 27' ' ' ILE . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.504 HG13 HD21 ' B' ' 13' ' ' LEU . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.166 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 83' ' ' ILE . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.528 ' HG2' HD13 ' A' ' 7' ' ' LEU . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' B' ' 22' ' ' ILE . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.499 HG21 ' HB3' ' B' ' 26' ' ' ASP . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.583 0 N-CA-C 108.352 -1.899 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 85' ' ' LEU . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.482 HG23 HG22 ' A' ' 30' ' ' VAL 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.499 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.437 ' CG1' HD22 ' B' ' 34' ' ' LEU . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.437 HD22 ' CG1' ' B' ' 30' ' ' VAL . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' B' ' 42' ' ' LEU . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' B' ' 39' ' ' ALA . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.43 HG22 HD11 ' A' ' 7' ' ' LEU . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m . . . . . 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' LEU 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.457 0 CA-C-O 117.962 -1.465 . . . . 0.0 115.011 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . 0.417 ' ND1' ' HG2' ' B' ' 81' ' ' LYS . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.443 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . 0.436 ' HA ' HE22 ' B' ' 35' ' ' GLN . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.436 HE22 ' HA ' ' B' ' 32' ' ' THR 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HG2' ' ND1' ' A' ' 98' ' ' HIS . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.415 HD13 ' HG3' ' B' ' 41' ' ' GLU . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.57 HG22 HG23 ' B' ' 22' ' ' ILE . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HB3' HD12 ' A' ' 53' ' ' ILE . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.587 HD12 ' HB3' ' A' ' 50' ' ' LEU . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t . . . . . 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 117.748 -1.584 . . . . 0.0 113.379 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.57 HG23 HG22 ' A' ' 30' ' ' VAL . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG3' HD13 ' A' ' 7' ' ' LEU . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HE2' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 4.6 tp-100 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 27' ' ' ILE 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.414 HG23 ' CD2' ' B' ' 51' ' ' PHE . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' HG3' ' B' ' 11' ' ' GLU . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' H ' ' A' ' 50' ' ' LEU 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t . . . . . 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.382 0 CA-C-O 117.49 -1.728 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.44 HD12 HG11 ' B' ' 87' ' ' VAL . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' LYS 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 37' ' ' VAL . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . 0.414 ' CD2' HG23 ' A' ' 32' ' ' THR . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . 0.404 ' CZ ' HD13 ' B' ' 85' ' ' LEU . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m . . . . . 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 117.85 1.9 . . . . 0.0 117.85 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.404 HD13 ' CZ ' ' B' ' 56' ' ' PHE 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.44 HG11 HD12 ' A' ' 83' ' ' ILE . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 7' ' ' LEU . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.424 ' CB ' HD11 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HD22 ' A' ' 58' ' ' LEU 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 HG23 ' A' ' 45' ' ' THR . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.312 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.424 HD11 ' CB ' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' B' ' 91' ' ' LEU . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 31' ' ' VAL . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.418 HG22 HG12 ' B' ' 22' ' ' ILE . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 27' ' ' ILE . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.414 HD21 ' HB3' ' A' ' 56' ' ' PHE . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.414 ' HB3' HD21 ' A' ' 42' ' ' LEU 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.506 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.479 ' OG ' HG22 ' A' ' 90' ' ' ILE . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.479 HG22 ' OG ' ' A' ' 88' ' ' SER 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 30' ' ' VAL . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 44' ' ' THR . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . 0.425 HG22 ' HA ' ' B' ' 41' ' ' GLU 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' THR . . . . . 0.446 HG23 ' HE3' ' B' ' 82' ' ' LYS . 6.6 m . . . . . 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.571 0 CA-C-O 122.807 1.226 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.446 ' HE3' HG23 ' B' ' 61' ' ' THR . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtp . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.77 130.78 37.15 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.624 2.369 . . . . 0.0 108.15 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -96.34 132.67 41.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.3 tp -151.18 173.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.926 1 C-N-CA 132.131 4.172 . . . . 0.0 104.121 176.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -60.44 128.85 38.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.413 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.263 78.9 p -158.24 161.61 37.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.356 -2.715 . . . . 0.0 113.18 -161.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.359 1.5 pt? -137.58 127.53 25.73 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 129.628 3.171 . . . . 0.0 114.627 171.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 t -76.26 174.24 10.39 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 163.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.16 -25.94 67.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.648 166.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.27 -26.89 64.03 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 126.868 2.605 . . . . 0.0 114.512 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.5 -42.46 95.82 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 130.688 3.595 . . . . 0.0 113.804 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -74.8 -36.55 62.48 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.252 1.821 . . . . 0.0 108.718 174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.96 -44.49 82.64 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 118.83 -2.419 . . . . 0.0 108.4 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -71.68 -38.24 70.63 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.65 -178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -61.13 -44.59 97.09 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 129.408 3.083 . . . . 0.0 110.483 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.91 -39.12 93.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -30.29 65.43 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 124.325 2.012 . . . . 0.0 110.693 175.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -77.49 -25.18 50.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 118.836 -2.415 . . . . 0.0 112.897 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -83.23 -28.07 29.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.08 2.952 . . . . 0.0 109.839 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.8 p -149.59 136.9 19.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -163.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -84.82 -18.63 34.33 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.592 3.157 . . . . 0.0 116.273 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.4 mt -69.99 -6.73 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 C-N-CA 129.501 3.12 . . . . 0.0 112.395 -169.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.343 8.9 pttp -145.84 145.82 30.9 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 114.833 -2.508 . . . . 0.0 113.755 -167.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.648 HG13 ' H ' ' A' ' 25' ' ' GLN 0.265 9.5 p -130.01 -112.94 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 113.665 -3.064 . . . . 0.0 108.877 -173.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.648 ' H ' HG13 ' A' ' 24' ' ' VAL 0.259 16.3 mt-30 -68.84 -19.19 64.25 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.539 1.774 . . . . 0.0 115.143 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.08 -7.31 1.75 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.539 2.736 . . . . 0.0 112.169 173.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.456 ' HA ' HG22 ' A' ' 30' ' ' VAL . 59.4 mt -75.41 -34.43 30.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 O-C-N 118.625 -2.547 . . . . 0.0 107.605 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 mtm180 -66.14 -45.88 79.45 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 126.391 1.876 . . . . 0.0 112.218 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 20.7 mt -47.02 -67.5 0.27 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.359 2.264 . . . . 0.0 113.724 162.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.456 HG22 ' HA ' ' A' ' 27' ' ' ILE 0.271 2.5 m -57.67 -35.55 51.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 124.753 1.221 . . . . 0.0 110.515 -170.035 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.3 t -77.71 -30.08 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 129.999 3.319 . . . . 0.0 110.602 -177.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.5 m -71.94 -41.39 67.89 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 118.478 -2.639 . . . . 0.0 111.412 165.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.8 p -66.18 -39.77 89.96 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 118.661 -2.524 . . . . 0.0 111.315 -173.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' B' ' 34' ' ' LEU . 19.7 mt -47.12 -26.45 1.11 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.636 2.774 . . . . 0.0 113.658 172.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -121.39 -30.8 4.19 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.304 -1.317 . . . . 0.0 113.004 -174.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -53.82 -44.46 70.24 Favored 'General case' 0 N--CA 1.451 -0.381 1 C-N-CA 133.983 4.913 . . . . 0.0 109.659 168.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.1 p -87.26 -5.22 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 CA-C-O 122.967 1.365 . . . . 0.0 113.291 -174.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.12 -55.18 4.18 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.26 -2.867 . . . . 0.0 103.26 177.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.33 -34.58 16.06 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 112.265 -3.731 . . . . 0.0 115.117 167.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -73.08 -34.73 66.4 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.226 2.285 . . . . 0.0 115.24 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -76.92 -39.84 49.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.949 2.031 . . . . 0.0 106.433 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.7 mt -61.91 -35.3 77.96 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.44 -27.41 66.15 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 127.997 2.519 . . . . 0.0 110.959 174.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.4 p -83.24 -6.91 59.63 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 122.137 2.244 . . . . 0.0 109.597 170.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.314 7.6 t 59.95 57.6 3.02 Favored 'General case' 0 N--CA 1.441 -0.889 1 C-N-CA 132.506 4.323 . . . . 0.0 114.712 -178.014 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.6 146.69 18.57 Favored Glycine 0 C--N 1.336 0.545 1 N-CA-C 101.912 -4.475 . . . . 0.0 101.912 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -71.38 133.93 46.31 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.99 110.7 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.777 162.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -98.66 97.25 8.53 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 118.773 2.879 . . . . 0.0 118.773 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 83.3 mt -92.52 104.32 16.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 102.38 -3.193 . . . . 0.0 102.38 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.41 119.09 7.32 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 130.007 3.323 . . . . 0.0 109.362 -176.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.655 0.3 OUTLIER 102.73 -7.45 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.484 1 C-N-CA 134.864 5.265 . . . . 0.0 118.035 178.288 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.256 4.0 pt -119.22 -25.74 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 124.614 2.15 . . . . 0.0 112.455 174.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.85 -161.98 12.87 Favored Glycine 0 C--N 1.334 0.466 1 O-C-N 116.102 -4.124 . . . . 0.0 116.075 -177.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.359 5.3 pttp -129.21 136.49 50.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -96.07 108.19 20.58 Favored 'General case' 0 N--CA 1.446 -0.63 1 C-N-CA 138.79 6.836 . . . . 0.0 105.384 178.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 mttt -113.43 131.29 56.07 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.23 138.89 58.69 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 125.781 1.926 . . . . 0.0 111.059 158.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.89 161.06 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 O-C-N 118.299 -2.751 . . . . 0.0 106.935 176.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.1 t -126.67 146.61 50.13 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.314 1.845 . . . . 0.0 110.002 160.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 28.2 m -98.88 105.09 17.2 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 105.148 -2.167 . . . . 0.0 105.148 167.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -52.19 151.48 6.97 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -74.62 147.71 36.1 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 122.132 1.797 . . . . 0.0 108.868 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER -144.82 130.8 19.3 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.057 1.343 . . . . 0.0 110.425 -175.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.7 t -48.87 125.8 10.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.278 2.231 . . . . 0.0 107.778 160.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -115.72 141.83 17.17 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-O 115.026 -3.097 . . . . 0.0 117.514 155.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 16.7 tt -134.28 125.0 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 119.885 1.842 . . . . 0.0 108.271 172.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -97.02 119.7 62.9 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 103.83 -2.656 . . . . 0.0 103.83 160.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.61 -36.26 18.42 Favored 'Trans proline' 0 N--CA 1.446 -1.315 1 C-N-CA 129.695 6.93 . . . . 0.0 119.465 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -80.65 -21.74 41.14 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -81.46 146.12 30.4 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 116.941 -3.599 . . . . 0.0 113.095 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -77.39 -34.03 54.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.772 1.169 . . . . 0.0 109.703 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -82.65 141.25 32.63 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.008 1.723 . . . . 0.0 111.112 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.6 mttp -97.21 103.94 15.92 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 128.216 2.606 . . . . 0.0 105.516 176.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.33 93.23 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 103.882 -2.636 . . . . 0.0 103.882 174.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -92.96 101.65 14.0 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 128.182 2.593 . . . . 0.0 108.963 174.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 77' ' ' ILE . 69.7 mt -70.15 120.17 76.49 Favored Pre-proline 0 N--CA 1.453 -0.305 0 O-C-N 119.868 -1.77 . . . . 0.0 108.831 -174.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.282 84.1 Cg_endo -66.65 -171.05 0.24 Allowed 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 124.594 3.53 . . . . 0.0 116.695 -177.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.324 . . -83.01 126.73 32.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 104.219 -2.511 . . . . 0.0 104.219 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.65 139.8 11.77 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 108.487 -1.845 . . . . 0.0 108.487 167.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -105.87 127.72 53.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 127.62 2.368 . . . . 0.0 110.532 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -141.41 178.04 7.7 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 127.706 2.402 . . . . 0.0 113.848 -167.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -116.04 135.77 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 175.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 ttpm? -104.04 143.62 32.65 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 124.878 1.271 . . . . 0.0 111.316 158.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.5 tp -102.91 138.01 40.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 171.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.1 p -120.34 129.59 54.05 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 168.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.5 m -65.86 150.09 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 C-N-CA 127.961 2.504 . . . . 0.0 115.378 -174.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.4 t -85.83 152.0 23.35 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 122.487 1.137 . . . . 0.0 108.237 163.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -43.78 71.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.27 1.828 . . . . 0.0 115.183 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.275 15.6 tt -73.5 -27.64 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 122.778 1.275 . . . . 0.0 112.321 -170.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 20.1 tp -77.82 -55.76 5.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.266 173.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.462 HG23 ' HA ' ' B' ' 82' ' ' LYS . 79.0 m -103.79 -41.43 5.91 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.96 -2.962 . . . . 0.0 115.584 -169.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -81.82 60.6 4.79 Favored 'General case' 0 N--CA 1.452 -0.374 1 O-C-N 114.494 -5.129 . . . . 0.0 117.769 -145.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.53 38.87 0.95 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 129.196 2.999 . . . . 0.0 114.258 -164.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -139.86 -148.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 104.462 -2.421 . . . . 0.0 104.462 -166.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.389 5.5 t70 -23.08 -67.67 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.321 1 C-N-CA 134.346 5.058 . . . . 0.0 113.625 -168.214 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.3 p -81.68 -8.53 59.71 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.314 -1.766 . . . . 0.0 111.133 -166.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -112.04 20.73 16.62 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.926 2.09 . . . . 0.0 108.427 -168.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 C--O 1.254 1.301 0 C-N-CA 131.253 3.821 . . . . 0.0 106.737 172.263 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.271 . . -136.17 -178.58 5.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 116.857 -3.652 . . . . 0.0 112.097 160.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -145.75 128.23 16.0 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -95.23 159.9 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 128.189 2.595 . . . . 0.0 111.742 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -55.86 -51.78 66.33 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 128.528 2.731 . . . . 0.0 109.188 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 6.0 t -60.6 -36.96 79.84 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 127.312 2.245 . . . . 0.0 111.839 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.79 -34.24 76.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.972 2.109 . . . . 0.0 115.418 170.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -63.44 -47.88 80.06 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 127.295 2.872 . . . . 0.0 111.741 167.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.96 -18.79 64.12 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.337 1.055 . . . . 0.0 111.723 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.42 -42.28 23.02 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.899 0.88 . . . . 0.0 111.59 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -81.06 -16.48 53.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.583 1.177 . . . . 0.0 108.656 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.494 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 27.5 m-85 -78.69 -24.79 44.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 116.562 -3.836 . . . . 0.0 110.088 170.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.21 -48.07 31.35 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -58.07 -23.4 54.48 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -98.85 -28.51 13.43 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.686 1.994 . . . . 0.0 108.659 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.9 mmm -116.06 31.74 6.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 121.418 1.917 . . . . 0.0 110.183 -175.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.19 -63.51 1.39 Allowed 'General case' 0 N--CA 1.443 -0.778 0 O-C-N 119.222 -2.173 . . . . 0.0 109.848 165.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 t70 62.24 -158.34 0.33 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 129.464 3.105 . . . . 0.0 110.537 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -56.53 -50.37 72.05 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.833 1.302 . . . . 0.0 113.785 158.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.296 15.1 t -146.42 141.2 26.91 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 130.358 3.463 . . . . 0.0 111.498 168.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.02 -82.22 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 120.375 1.443 . . . . 0.0 107.44 168.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 17.5 tt -144.9 151.7 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -172.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -108.63 156.94 18.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 123.606 1.669 . . . . 0.0 108.478 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.6 p -29.31 -38.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.56 2 C-N-CA 133.516 4.726 . . . . 0.0 117.307 170.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -97.75 -8.09 29.32 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 122.446 2.385 . . . . 0.0 106.492 -176.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -96.3 -40.21 9.26 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.532 1.133 . . . . 0.0 110.011 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 12' ' ' TYR . 10.6 tp -61.34 -32.16 52.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 126.285 1.834 . . . . 0.0 108.993 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -63.37 -23.39 67.39 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.739 1.616 . . . . 0.0 113.892 170.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.4 tp -92.14 -51.55 5.12 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 120.748 1.613 . . . . 0.0 108.95 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -39.34 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 122.263 2.301 . . . . 0.0 114.532 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -64.62 -34.93 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 126.425 1.89 . . . . 0.0 109.881 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -96.23 -34.65 11.56 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.298 1.839 . . . . 0.0 110.371 -171.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -56.06 -45.4 79.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.342 1.026 . . . . 0.0 110.639 167.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.545 HD22 HD22 ' A' ' 34' ' ' LEU . 11.6 tp -45.51 -63.13 1.02 Allowed 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.842 2.258 . . . . 0.0 113.366 177.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -74.25 -21.58 59.71 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 128.009 2.524 . . . . 0.0 116.318 -175.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.92 -54.6 10.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 126.333 1.853 . . . . 0.0 112.915 161.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -65.24 -41.83 92.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 119.784 1.175 . . . . 0.0 112.603 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 10.2 mp -61.98 -29.16 70.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 174.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.61 65.08 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 117.616 -3.177 . . . . 0.0 113.821 169.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -60.09 -29.06 68.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 120.767 -1.208 . . . . 0.0 113.484 172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.432 ' HA ' HG22 ' B' ' 44' ' ' THR . 47.4 mm-40 -89.33 -17.68 28.43 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.191 1.552 . . . . 0.0 115.191 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.35 22.2 mt -82.33 -25.77 33.61 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 114.231 -2.795 . . . . 0.0 110.359 161.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.46 -42.59 87.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.637 2.017 . . . . 0.0 115.078 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . 0.432 HG22 ' HA ' ' B' ' 41' ' ' GLU . 2.0 t -77.63 8.17 4.73 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 128.156 2.582 . . . . 0.0 115.754 173.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.377 12.8 t 71.88 37.78 1.01 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 131.249 3.82 . . . . 0.0 111.892 175.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.88 160.46 19.47 Favored Glycine 0 CA--C 1.524 0.609 0 CA-C-O 123.523 1.624 . . . . 0.0 116.147 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -110.46 122.95 48.95 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 119.865 -1.962 . . . . 0.0 105.705 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -83.59 117.26 29.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -105.35 109.67 21.74 Favored 'General case' 0 N--CA 1.444 -0.766 1 O-C-N 114.94 -4.85 . . . . 0.0 107.292 168.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.69 96.35 6.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 117.254 -1.355 . . . . 0.0 107.912 175.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -48.57 127.75 13.89 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.464 1.905 . . . . 0.0 111.638 167.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.498 10.0 t70 107.1 -39.21 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.457 1 O-C-N 129.856 4.472 . . . . 0.0 115.663 -177.892 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 8.4 tt -101.4 -57.46 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 O-C-N 118.385 -2.697 . . . . 0.0 112.269 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.91 -156.73 27.15 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 121.64 2.018 . . . . 0.0 108.501 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -136.95 130.05 30.99 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 119.795 -2.003 . . . . 0.0 107.516 -158.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -106.16 134.5 49.19 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 127.273 2.229 . . . . 0.0 107.755 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -149.23 158.7 44.4 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 120.171 -1.581 . . . . 0.0 109.128 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.32 33.0 mt -82.15 162.94 22.28 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 125.972 2.796 . . . . 0.0 111.026 173.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.329 9.8 p -144.35 139.46 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 116.618 -3.801 . . . . 0.0 106.034 172.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.5 p -131.02 114.92 15.79 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -173.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.7 m -52.18 112.04 0.73 Allowed 'General case' 0 N--CA 1.451 -0.388 1 N-CA-C 99.845 -4.131 . . . . 0.0 99.845 169.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -61.58 116.6 21.33 Favored Pre-proline 0 N--CA 1.454 -0.237 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -158.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.22 123.73 8.99 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 N-CA-C 108.674 -1.318 . . . . 0.0 108.674 -176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 33.9 ttp85 -77.44 159.63 29.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 112.836 -1.983 . . . . 0.0 111.346 167.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 8.1 t -100.4 139.79 35.58 Favored 'General case' 0 N--CA 1.443 -0.816 0 O-C-N 116.954 -3.591 . . . . 0.0 103.817 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -124.73 145.73 15.88 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.302 -2.719 . . . . 0.0 106.302 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 23.7 mm -106.32 93.04 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 1 N-CA-C 98.858 -4.497 . . . . 0.0 98.858 168.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -96.29 141.06 22.59 Favored Pre-proline 0 C--O 1.221 -0.418 0 C-N-CA 127.948 2.499 . . . . 0.0 109.574 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . 0.305 60.5 Cg_endo -56.55 99.05 0.08 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.278 1 C-N-CA 126.19 4.593 . . . . 0.0 115.256 -177.762 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.416 47.2 tptt -150.21 -101.24 0.07 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.366 2.266 . . . . 0.0 112.128 169.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 84.8 m -113.69 174.02 6.13 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.193 1.797 . . . . 0.0 111.584 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -39.89 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 118.39 2.737 . . . . 0.0 118.39 167.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -70.6 149.03 47.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 129.542 3.137 . . . . 0.0 107.208 -175.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -87.03 143.37 27.36 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 124.349 2.023 . . . . 0.0 109.071 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -119.98 121.09 65.07 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 O-C-N 119.573 -1.954 . . . . 0.0 106.685 -172.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -73.62 137.82 44.46 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.278 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.85 134.99 85.62 Favored Pre-proline 0 N--CA 1.443 -0.815 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 163.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -65.58 130.24 24.49 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.693 1.595 . . . . 0.0 111.409 -160.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.316 . . -83.81 153.49 24.04 Favored 'General case' 0 C--N 1.332 -0.192 0 O-C-N 117.564 -3.21 . . . . 0.0 114.442 169.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.12 122.09 7.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 107.779 -2.129 . . . . 0.0 107.779 167.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -112.29 113.69 26.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -167.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.462 ' HA ' HG23 ' A' ' 92' ' ' THR . 39.0 mttt -126.56 173.34 9.51 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.498 2.719 . . . . 0.0 114.965 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 pt -120.45 150.07 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 120.634 1.561 . . . . 0.0 107.98 170.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.317 40.0 ttmt -121.55 145.4 48.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.637 1.975 . . . . 0.0 109.251 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt -112.96 128.05 56.38 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 129.42 3.088 . . . . 0.0 105.485 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.0 t -119.37 128.38 54.02 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 124.951 1.301 . . . . 0.0 108.98 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 61.2 t -83.26 142.07 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 126.082 1.753 . . . . 0.0 110.363 -162.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -80.89 157.86 25.5 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 116.279 -1.819 . . . . 0.0 112.048 172.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -45.74 -58.18 3.68 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 129.802 4.438 . . . . 0.0 112.852 178.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 19.6 mm -56.1 -30.79 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 O-C-N 118.19 -2.818 . . . . 0.0 114.513 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -62.05 1.71 Allowed 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 119.171 -2.206 . . . . 0.0 106.109 177.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 13.1 t -60.0 -31.68 70.15 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 117.492 -3.255 . . . . 0.0 112.17 -175.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -76.42 -34.72 58.79 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 122.398 2.363 . . . . 0.0 108.818 -177.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.46 -16.06 58.97 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.418 -2.051 . . . . 0.0 113.217 175.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.283 2.5 t -85.8 -49.61 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 129.299 3.039 . . . . 0.0 110.266 172.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -52.56 -30.0 28.53 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.881 2.872 . . . . 0.0 117.522 165.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.7 m -79.85 130.79 35.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.87 -1.769 . . . . 0.0 110.185 170.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -80.61 136.32 36.22 Favored 'General case' 0 N--CA 1.453 -0.31 1 O-C-N 115.786 -4.321 . . . . 0.0 105.383 -178.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt . . . . . 0 C--O 1.254 1.307 0 CA-C-N 124.313 3.233 . . . . 0.0 108.313 172.289 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.47 140.92 43.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.911 2.085 . . . . 0.0 107.115 166.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 0.472 77.2 mttt -125.01 153.86 42.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.112 2.133 . . . . 0.0 113.315 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.0 tt -165.98 148.37 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 O-C-N 118.223 -2.798 . . . . 0.0 103.718 168.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . 0.282 62.6 tttt -112.08 112.37 23.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 98.5 p -139.11 126.73 21.86 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.974 3.31 . . . . 0.0 109.905 171.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 7' ' ' LEU . 1.6 pt? -72.81 166.28 23.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -173.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -142.72 168.7 19.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 102.265 -3.235 . . . . 0.0 102.265 -170.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.54 -28.07 0.87 Allowed 'General case' 0 C--O 1.24 0.581 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.34 61.31 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 112.524 -2.126 . . . . 0.0 112.093 -175.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -75.35 -36.72 60.94 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.41 -1.757 . . . . 0.0 106.771 -167.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -42.33 -40.72 2.58 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 117.96 2.578 . . . . 0.0 117.96 167.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.57 -18.29 64.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.455 1.902 . . . . 0.0 111.9 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -73.07 -38.76 66.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -64.25 -58.51 6.35 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 119.424 -2.047 . . . . 0.0 107.526 174.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.5 ttt -75.01 4.3 6.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.199 1.952 . . . . 0.0 114.381 -158.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.88 66.08 Favored 'General case' 0 N--CA 1.446 -0.643 1 C-N-CA 132.357 4.263 . . . . 0.0 114.757 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.5 -36.15 33.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.893 2.477 . . . . 0.0 112.036 171.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -90.07 -25.72 20.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.733 -1.854 . . . . 0.0 114.374 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.1 p -116.3 145.43 43.18 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 116.861 -3.649 . . . . 0.0 107.424 172.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.255 17.6 p30 -147.11 -2.59 0.6 Allowed 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 128.897 3.873 . . . . 0.0 117.844 159.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.372 24.3 pt -117.88 9.58 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 1 O-C-N 115.966 -4.209 . . . . 0.0 114.426 178.539 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.35 43.9 pttt -150.91 140.77 21.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.149 2.179 . . . . 0.0 110.528 170.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.357 14.4 p -154.21 -47.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 129.554 3.142 . . . . 0.0 109.293 -164.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -77.11 -36.11 55.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 124.325 1.016 . . . . 0.0 110.638 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -71.81 -22.4 61.57 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.454 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 27' ' ' ILE . 76.4 mt -65.0 -28.69 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 129.235 3.014 . . . . 0.0 111.635 174.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -84.75 -25.93 27.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 118.926 -2.359 . . . . 0.0 109.773 -161.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.74 -43.13 89.92 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 126.908 2.083 . . . . 0.0 112.527 171.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.6 -50.94 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 C-N-CA 128.049 2.54 . . . . 0.0 109.304 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.298 5.8 t -54.92 -33.73 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 125.183 1.393 . . . . 0.0 110.839 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 62.7 m -69.66 -44.49 70.45 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 119.695 3.22 . . . . 0.0 119.695 167.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.312 77.6 p -52.98 -36.82 60.73 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 120.001 3.334 . . . . 0.0 120.001 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD21 HG22 ' B' ' 31' ' ' VAL . 10.9 mp -51.98 -31.38 29.04 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.871 2.469 . . . . 0.0 111.242 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -104.19 -47.82 4.04 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 119.633 -1.917 . . . . 0.0 105.889 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -56.67 -57.8 10.83 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.687 1.995 . . . . 0.0 114.861 -169.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -88.71 2.93 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 117.546 -1.216 . . . . 0.0 111.198 -175.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.33 -39.47 25.09 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 103.704 -2.702 . . . . 0.0 103.704 167.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.6 -26.97 45.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -167.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -58.62 -39.82 81.56 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 127.079 2.151 . . . . 0.0 109.012 171.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' HD2' ' B' ' 3' ' ' LYS . 5.5 tp10 -69.24 -50.75 44.27 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 125.401 1.48 . . . . 0.0 110.586 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -63.36 -31.53 72.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.091 1.756 . . . . 0.0 113.208 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.89 -9.96 59.17 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 128.448 3.593 . . . . 0.0 114.589 177.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 45' ' ' THR . 74.0 p -110.69 8.77 22.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.743 1.617 . . . . 0.0 110.128 169.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 44' ' ' THR 0.365 12.6 t 70.45 41.2 1.01 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 125.618 2.628 . . . . 0.0 111.919 168.056 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -102.65 132.27 10.94 Favored Glycine 0 CA--C 1.524 0.617 1 N-CA-C 100.996 -4.842 . . . . 0.0 100.996 -169.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -91.88 106.48 18.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 113.17 -3.3 . . . . 0.0 106.204 -170.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.2 t -89.09 130.17 38.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-O 126.411 3.005 . . . . 0.0 110.58 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -99.85 140.96 33.31 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 118.605 -2.559 . . . . 0.0 110.961 164.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' B' ' 5' ' ' LYS . 19.3 mt -118.26 90.58 3.36 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 115.682 -2.104 . . . . 0.0 107.891 170.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -53.03 128.55 27.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 121.42 1.918 . . . . 0.0 113.955 170.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.658 0.0 OUTLIER 96.39 -0.79 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 119.141 3.015 . . . . 0.0 119.141 -166.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 53' ' ' ILE . 77.8 mt -134.47 -48.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 129.328 3.051 . . . . 0.0 110.478 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.89 -140.47 12.43 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 107.669 -2.172 . . . . 0.0 107.669 -175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.481 45.9 pttt -127.99 162.9 25.72 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.783 2.882 . . . . 0.0 118.783 176.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -96.32 97.11 9.23 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 110.06 -3.246 . . . . 0.0 103.797 162.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -76.21 140.66 41.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 129.411 3.084 . . . . 0.0 108.301 174.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.18 126.82 50.54 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 119.531 -1.98 . . . . 0.0 106.505 165.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.7 m -113.0 169.57 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 N-CA-C 102.664 -3.087 . . . . 0.0 102.664 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 12.8 t -143.15 101.25 3.78 Favored 'General case' 0 N--CA 1.441 -0.923 0 O-C-N 117.321 -3.362 . . . . 0.0 106.417 -177.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.283 4.5 p -79.17 122.92 26.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.509 1.124 . . . . 0.0 108.197 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.2 pttt -73.1 156.59 89.37 Favored Pre-proline 0 N--CA 1.451 -0.408 0 CA-C-N 120.879 1.672 . . . . 0.0 112.728 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.91 150.58 83.03 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.888 1.725 . . . . 0.0 109.701 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -160.11 169.82 22.52 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 -155.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.289 2.9 t -146.94 134.57 21.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.77 2.224 . . . . 0.0 108.548 -172.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -127.88 175.15 18.48 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-O 116.504 -2.276 . . . . 0.0 110.729 160.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 2.6 pt -97.52 164.56 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 122.722 3.261 . . . . 0.0 110.115 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -80.64 148.93 66.9 Favored Pre-proline 0 N--CA 1.451 -0.406 0 O-C-N 118.808 -2.432 . . . . 0.0 109.173 165.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -83.45 -26.15 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 CA-C-N 122.476 1.92 . . . . 0.0 114.98 -159.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.291 32.7 mtmt -124.5 -10.55 7.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 119.795 1.18 . . . . 0.0 110.371 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 80.3 p -109.82 172.09 7.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 122.05 2.205 . . . . 0.0 108.326 163.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -93.03 -19.36 21.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.112 -1.618 . . . . 0.0 111.504 -170.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -57.32 138.51 54.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 116.713 2.116 . . . . 0.0 116.713 -177.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -84.69 144.13 28.74 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 118.61 -2.556 . . . . 0.0 107.309 -176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.0 mt -84.0 129.03 38.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 167.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.49 125.57 41.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 118.855 -1.138 . . . . 0.0 110.46 162.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 mt -89.79 142.37 29.07 Favored Pre-proline 0 N--CA 1.453 -0.303 0 CA-C-O 116.061 -1.923 . . . . 0.0 108.116 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -80.34 173.72 12.14 Favored 'Trans proline' 0 N--CA 1.439 -1.719 1 C-N-CA 126.244 4.629 . . . . 0.0 113.833 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.7 121.35 27.54 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 100.503 -3.888 . . . . 0.0 100.503 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -111.39 140.39 16.06 Favored Glycine 0 C--N 1.335 0.525 0 O-C-N 119.462 -2.024 . . . . 0.0 111.642 173.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -108.68 126.34 52.88 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 128.862 3.331 . . . . 0.0 103.75 161.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -141.77 176.33 9.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 119.672 1.124 . . . . 0.0 110.202 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 26.8 mm -114.42 152.27 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -130.07 140.27 50.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 118.887 -2.383 . . . . 0.0 106.957 164.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.4 tp -89.88 116.46 27.97 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 161.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.7 p -113.4 104.69 12.55 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 128.415 3.959 . . . . 0.0 108.231 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.3 m -62.6 177.01 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 109.694 -3.412 . . . . 0.0 115.85 178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.2 t -143.7 172.7 12.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.426 1.584 . . . . 0.0 109.621 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.98 -20.98 65.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 117.325 -3.359 . . . . 0.0 115.275 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -14.0 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 116.516 -1.707 . . . . 0.0 114.014 172.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.287 47.5 tp -125.99 -44.74 1.75 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 129.838 3.255 . . . . 0.0 109.939 -171.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.267 28.6 m -127.87 59.49 1.47 Allowed 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 128.005 3.315 . . . . 0.0 109.169 -163.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -151.65 121.03 6.83 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 122.087 2.221 . . . . 0.0 108.046 171.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.258 . . 66.16 -9.18 0.31 Allowed 'General case' 0 N--CA 1.443 -0.817 1 C-N-CA 134.417 5.087 . . . . 0.0 115.188 173.76 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 12.3 p -161.02 171.3 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.299 6.2 m-20 79.82 -52.09 0.39 Allowed 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.406 4.283 . . . . 0.0 115.298 159.737 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.257 48.5 p -146.52 26.19 1.17 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 128.847 2.859 . . . . 0.0 112.519 170.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.353 1.4 t60 -159.75 47.6 0.28 Allowed 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 120.504 -1.372 . . . . 0.0 111.667 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.7 tttt . . . . . 0 C--O 1.251 1.143 1 N-CA-C 99.807 -4.146 . . . . 0.0 99.807 168.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 20.5 ptt? . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.11 158.7 34.81 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 127.896 2.479 . . . . 0.0 112.265 -172.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . 0.51 ' HD2' ' HG2' ' A' ' 41' ' ' GLU . 28.7 tttt -139.62 142.62 37.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.788 2.035 . . . . 0.0 114.916 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 pt -117.8 146.7 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 1 C-N-CA 133.418 4.687 . . . . 0.0 112.313 -175.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.426 ' HG3' HD22 ' A' ' 50' ' ' LEU . 32.4 tttt -44.9 -46.13 10.74 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 128.624 2.77 . . . . 0.0 115.143 -172.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 42.9 t -45.3 -57.52 3.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.024 2.129 . . . . 0.0 112.869 168.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -79.21 -1.69 37.56 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 58.2 m -83.47 -41.24 18.26 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 114.785 -2.531 . . . . 0.0 106.826 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -61.05 -36.23 79.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 128.509 2.724 . . . . 0.0 112.604 172.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.0 -16.29 60.63 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.204 1.002 . . . . 0.0 113.328 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -93.85 -32.55 13.89 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-O 116.86 -1.543 . . . . 0.0 111.909 174.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 19.2 m-30 -63.06 -30.2 71.41 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 120.726 1.603 . . . . 0.0 109.67 168.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 22.4 tp -80.89 -29.45 35.67 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 120.156 1.344 . . . . 0.0 112.981 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -68.56 -39.45 81.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 116.943 -1.504 . . . . 0.0 108.566 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.288 18.8 mm-40 -70.98 -29.11 64.99 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 114.289 -2.767 . . . . 0.0 116.617 176.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.9 tpt -143.89 96.59 2.92 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 128.291 3.494 . . . . 0.0 115.065 176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.57 3.43 16.72 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 123.99 3.087 . . . . 0.0 116.144 161.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 83.73 -83.46 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 129.48 3.112 . . . . 0.0 108.497 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -125.68 -48.98 1.64 Allowed 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.145 4.578 . . . . 0.0 108.012 147.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -149.11 0.56 0.52 Allowed 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.801 -1.812 . . . . 0.0 115.507 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -75.58 -37.27 60.02 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.223 2.209 . . . . 0.0 115.78 -163.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.84 157.85 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 125.123 1.514 . . . . 0.0 107.858 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.04 160.02 43.29 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 131.481 3.912 . . . . 0.0 101.315 -172.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 p -53.85 -35.97 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 C-N-CA 130.271 3.429 . . . . 0.0 109.473 -172.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -59.43 -45.37 91.75 Favored 'General case' 0 C--N 1.342 0.258 0 O-C-N 117.736 -3.103 . . . . 0.0 107.95 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -68.91 -40.59 79.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 121.307 1.867 . . . . 0.0 115.035 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.22 -49.39 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 129.216 3.006 . . . . 0.0 109.56 166.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.408 ' O ' HG22 ' B' ' 32' ' ' THR . 31.8 ttp180 -76.91 -27.8 55.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.832 2.583 . . . . 0.0 113.193 -167.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.58 -40.2 96.12 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 130.703 3.601 . . . . 0.0 115.099 166.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.284 48.4 t -55.92 -61.58 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 CA-C-O 123.312 1.53 . . . . 0.0 112.647 162.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.742 HG22 HD21 ' A' ' 34' ' ' LEU . 74.8 t -54.22 -48.04 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 118.012 2.597 . . . . 0.0 118.012 -173.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . 0.408 HG22 ' O ' ' B' ' 28' ' ' ARG . 6.2 t -59.19 -33.73 71.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 130.545 3.538 . . . . 0.0 113.143 173.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 23.8 t -88.19 -54.51 4.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 113.651 -3.071 . . . . 0.0 113.469 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.5 tt -40.38 -49.37 2.8 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 128.175 2.59 . . . . 0.0 113.933 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.24 -22.8 65.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 116.675 -2.01 . . . . 0.0 114.793 -177.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -74.31 -41.41 61.19 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 127.325 2.25 . . . . 0.0 106.945 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 34.9 t -66.87 -49.81 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 O-C-N 119.88 -1.762 . . . . 0.0 109.421 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.114 -1.616 . . . . 0.0 113.916 171.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.18 -49.12 65.82 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 121.111 1.778 . . . . 0.0 109.843 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -57.39 -42.4 82.12 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 128.445 2.698 . . . . 0.0 114.092 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -78.78 -21.26 48.12 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.234 2.214 . . . . 0.0 112.343 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -77.98 -50.18 12.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 120.944 1.702 . . . . 0.0 114.282 161.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.261 . . -34.84 -43.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 125.585 2.612 . . . . 0.0 115.911 173.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.0 t -91.24 7.46 40.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 O-C-N 117.35 -3.344 . . . . 0.0 110.517 -166.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.395 25.3 m 94.76 45.66 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.631 1.972 . . . . 0.0 110.334 168.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.55 162.61 12.9 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 127.544 2.497 . . . . 0.0 113.032 -157.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -119.34 124.32 46.33 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.608 1.563 . . . . 0.0 112.373 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.5 t -97.14 119.0 44.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 18.1 mtm180 -76.95 112.42 13.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 129.564 3.146 . . . . 0.0 111.614 170.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.7 mt -139.79 153.7 47.2 Favored 'General case' 0 N--CA 1.446 -0.658 1 N-CA-C 99.23 -4.359 . . . . 0.0 99.23 178.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.252 8.3 t80 -121.84 -172.75 2.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 127.557 2.343 . . . . 0.0 107.157 170.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 13.6 t0 79.56 -70.63 0.09 Allowed 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 128.219 2.607 . . . . 0.0 110.011 174.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 tt -91.83 -39.66 11.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 C-N-CA 128.999 2.919 . . . . 0.0 112.709 177.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 129.19 164.64 11.52 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 123.387 2.812 . . . . 0.0 113.756 171.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -79.35 152.88 30.18 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 121.453 2.626 . . . . 0.0 112.872 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -110.36 145.24 37.86 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 105.064 -2.199 . . . . 0.0 105.064 178.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -144.34 158.36 43.78 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 124.03 1.871 . . . . 0.0 108.114 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 tp -81.01 146.27 30.75 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 118.225 -2.797 . . . . 0.0 111.552 167.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 p -128.29 141.63 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 117.246 -3.409 . . . . 0.0 103.805 170.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.9 p -137.31 140.04 41.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 100.697 -3.816 . . . . 0.0 100.697 -155.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 85.3 m -96.11 145.25 25.65 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 117.005 -3.56 . . . . 0.0 109.828 154.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 31.0 ttmt -63.45 134.89 96.02 Favored Pre-proline 0 N--CA 1.44 -0.925 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.96 155.95 38.68 Favored 'Trans proline' 0 N--CA 1.445 -1.372 0 CA-C-N 121.297 1.499 . . . . 0.0 115.493 178.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -73.98 148.93 41.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 126.847 2.059 . . . . 0.0 114.002 160.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t -100.72 154.09 18.9 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 124.376 2.036 . . . . 0.0 109.068 172.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -136.69 163.34 25.24 Favored Glycine 0 N--CA 1.447 -0.608 1 C-N-CA 131.451 4.358 . . . . 0.0 109.064 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -126.43 136.88 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 127.064 2.146 . . . . 0.0 105.792 170.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -80.68 131.9 59.52 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-O 117.152 -1.404 . . . . 0.0 109.299 170.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -81.79 4.08 7.31 Favored 'Trans proline' 0 N--CA 1.45 -1.045 0 N-CA-C 117.32 2.008 . . . . 0.0 117.32 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -94.58 -57.15 2.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 121.197 -0.939 . . . . 0.0 110.381 -172.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.8 t -137.61 154.43 49.76 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.084 167.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . 0.309 13.5 ttpt -48.32 73.65 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 117.727 2.491 . . . . 0.0 117.727 168.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -138.43 147.63 43.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 167.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -98.31 145.88 26.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 119.168 -2.208 . . . . 0.0 107.331 -160.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 22.4 mt -126.17 129.2 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 129.084 2.953 . . . . 0.0 105.105 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.303 8.2 tt0 -103.41 116.03 31.66 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.683 -2.71 . . . . 0.0 103.683 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 8.3 mt -104.36 128.4 27.1 Favored Pre-proline 0 N--CA 1.453 -0.285 1 CA-C-O 111.269 -4.205 . . . . 0.0 107.918 -172.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -80.74 165.79 19.85 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 O-C-N 127.096 3.156 . . . . 0.0 109.045 -169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -140.83 -20.34 0.81 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 110.949 -2.841 . . . . 0.0 115.673 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 148.86 113.99 0.72 Allowed Glycine 0 C--N 1.336 0.573 0 CA-C-N 120.36 1.436 . . . . 0.0 115.423 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -125.99 153.4 44.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 118.408 -2.819 . . . . 0.0 107.734 168.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.5 pttt -159.31 162.78 36.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 128.984 2.913 . . . . 0.0 108.908 172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.0 pt -97.87 166.24 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 O-C-N 118.624 -2.548 . . . . 0.0 108.73 169.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -142.5 154.31 44.39 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 112.362 -2.199 . . . . 0.0 112.494 -174.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 12.3 tp -106.33 128.69 54.19 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 103.737 -2.69 . . . . 0.0 103.737 167.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 13.6 t -101.67 118.1 36.24 Favored 'General case' 0 N--CA 1.45 -0.469 1 CA-C-O 130.828 5.108 . . . . 0.0 105.529 165.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 8.5 t -69.06 137.19 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 116.535 -3.853 . . . . 0.0 114.848 -172.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 11.4 t -63.35 147.97 49.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.337 1.855 . . . . 0.0 115.178 167.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -55.03 -39.51 69.21 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 131.32 3.848 . . . . 0.0 113.112 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 28.5 mm -72.63 -38.1 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 126.033 2.825 . . . . 0.0 105.934 -178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -75.71 -51.6 12.34 Favored 'General case' 0 CA--C 1.516 -0.332 1 O-C-N 113.719 -5.613 . . . . 0.0 110.579 -165.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 6.0 t -62.23 -18.5 61.33 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.38 -45.02 49.57 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 176.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.77 -29.21 69.67 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 129.175 2.99 . . . . 0.0 109.904 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.13 -24.03 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 111.842 -2.436 . . . . 0.0 112.153 -175.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.63 -35.22 70.35 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 120.878 -1.139 . . . . 0.0 110.974 170.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 6.0 m -68.14 121.29 15.86 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 124.77 1.294 . . . . 0.0 107.84 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -76.9 110.76 11.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.74 3.216 . . . . 0.0 108.726 168.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 31.2 pttt . . . . . 0 C--O 1.258 1.505 0 C-N-CA 128.75 2.82 . . . . 0.0 109.676 172.103 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 102.255 -3.239 . . . . 0.0 102.255 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.47 137.7 38.82 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 167.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -85.29 98.71 10.68 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.467 -2.049 . . . . 0.0 105.467 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.6 tt -163.82 135.22 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.206 3.441 . . . . 0.0 110.342 -175.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -94.1 158.86 15.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.474 1.109 . . . . 0.0 109.241 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.7 p -164.82 137.34 4.57 Favored 'General case' 0 CA--C 1.518 -0.283 1 O-C-N 129.605 4.316 . . . . 0.0 106.417 172.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 163.35 17.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 116.751 -1.595 . . . . 0.0 113.249 -175.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.262 10.2 t -136.3 -148.61 0.3 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 160.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.51 -33.19 74.4 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 -174.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.85 -25.67 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 117.222 2.304 . . . . 0.0 117.222 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -77.02 -24.41 52.12 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 112.725 -2.034 . . . . 0.0 105.534 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -87.13 -29.13 22.05 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 118.511 -2.618 . . . . 0.0 105.826 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.93 -18.38 65.35 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 121.478 1.944 . . . . 0.0 113.282 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -77.46 -26.85 51.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.971 2.908 . . . . 0.0 110.716 168.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -87.89 -24.33 23.68 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 122.882 2.583 . . . . 0.0 114.067 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -105.71 16.26 25.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.437 2.695 . . . . 0.0 106.724 -177.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.41 -22.94 66.83 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.449 -171.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -71.1 -25.21 62.5 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -82.27 -25.41 34.07 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.803 1.641 . . . . 0.0 114.737 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.9 p -83.47 116.18 22.41 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 119.118 -2.239 . . . . 0.0 107.694 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.254 12.5 p-10 -143.27 -43.53 0.29 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 126.342 1.857 . . . . 0.0 112.234 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.54 -23.8 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 116.192 -1.861 . . . . 0.0 111.807 175.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -124.04 143.43 50.44 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 122.43 2.377 . . . . 0.0 107.747 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.342 7.8 p -154.97 -28.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 O-C-N 119.331 -2.106 . . . . 0.0 110.109 -169.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -78.54 -31.99 47.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.89 -3.006 . . . . 0.0 116.375 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.87 -18.89 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 125.689 1.868 . . . . 0.0 113.977 -168.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mp -69.85 -27.23 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 125.887 1.675 . . . . 0.0 109.298 173.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -50.53 -42.32 54.99 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 121.961 2.164 . . . . 0.0 115.691 166.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mp -81.3 -26.19 35.87 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 112.328 -2.214 . . . . 0.0 111.951 -175.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.638 HG11 HG21 ' B' ' 30' ' ' VAL . 98.1 t -60.83 -46.93 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 O-C-N 120.988 -1.07 . . . . 0.0 110.173 166.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.4 t -69.42 -28.21 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 m -80.44 -26.87 38.13 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.001 -2.937 . . . . 0.0 117.786 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.2 p -62.91 -36.42 83.32 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 122.55 1.167 . . . . 0.0 114.081 170.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.1 mp -59.87 -16.89 32.6 Favored 'General case' 0 N--CA 1.444 -0.742 1 CA-C-O 111.421 -4.133 . . . . 0.0 114.283 167.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -105.06 -39.02 6.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 123.669 2.94 . . . . 0.0 109.569 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.292 27.1 tttt -74.09 -33.89 63.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 112.748 -2.023 . . . . 0.0 112.955 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.45 -15.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 117.023 -1.871 . . . . 0.0 111.673 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -59.29 3.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.685 -1.26 . . . . 0.0 109.652 161.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . 0.278 . . -39.69 -55.86 1.82 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.848 3.659 . . . . 0.0 113.684 172.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -45.05 -37.5 4.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.984 3.314 . . . . 0.0 113.014 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -82.62 -49.57 9.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 126.646 2.466 . . . . 0.0 107.012 -175.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.454 HD22 HD12 ' A' ' 83' ' ' ILE . 35.2 mt -74.62 -23.94 58.78 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 115.729 -2.081 . . . . 0.0 111.656 -175.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.04 -3.16 30.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 131.325 3.85 . . . . 0.0 115.195 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -124.7 25.64 7.42 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 125.044 1.337 . . . . 0.0 108.973 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.503 11.5 t 70.51 38.83 1.27 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 131.321 3.849 . . . . 0.0 110.015 178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.83 115.44 4.83 Favored Glycine 0 N--CA 1.449 -0.457 0 O-C-N 117.769 -3.082 . . . . 0.0 107.89 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -66.36 136.28 55.56 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.163 1.482 . . . . 0.0 114.186 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 8.6 t -122.11 103.38 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.739 -1.85 . . . . 0.0 106.578 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.2 ttp85 -99.29 89.74 4.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 128.078 2.551 . . . . 0.0 105.811 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.447 HD22 ' HG3' ' B' ' 5' ' ' LYS . 77.5 mt -87.47 92.52 9.12 Favored 'General case' 0 CA--C 1.518 -0.256 0 O-C-N 118.719 -2.488 . . . . 0.0 112.288 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -65.91 121.28 14.73 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 104.141 -2.541 . . . . 0.0 104.141 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.519 0.0 OUTLIER 95.14 3.1 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.536 1 C-N-CA 132.58 4.352 . . . . 0.0 117.068 -168.803 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.9 mt -122.63 -61.27 1.98 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.267 0 CA-C-O 124.467 2.079 . . . . 0.0 110.416 171.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.61 -158.26 27.27 Favored Glycine 0 N--CA 1.442 -0.901 0 O-C-N 117.345 -3.347 . . . . 0.0 110.318 -158.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -144.87 133.48 22.12 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 125.076 2.37 . . . . 0.0 109.372 -167.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -86.26 106.53 17.41 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 164.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -105.69 136.96 44.35 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 129.404 3.082 . . . . 0.0 108.715 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 mt -86.78 108.79 18.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 125.618 2.628 . . . . 0.0 107.923 178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 m -98.09 174.17 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 O-C-N 119.705 -1.872 . . . . 0.0 109.878 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.272 14.0 t -162.87 148.83 12.23 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.644 2.465 . . . . 0.0 109.778 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.4 p -117.29 138.46 51.73 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 123.299 1.523 . . . . 0.0 114.58 167.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 62' ' ' LYS . 26.6 pttt -70.87 152.17 95.08 Favored Pre-proline 0 N--CA 1.445 -0.686 0 O-C-N 119.549 -1.969 . . . . 0.0 114.933 175.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -75.57 150.76 36.22 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 O-C-N 125.922 2.538 . . . . 0.0 113.015 176.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -150.96 170.47 19.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 130.973 3.709 . . . . 0.0 108.98 -166.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.301 10.1 t -138.61 147.24 42.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 168.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -125.79 -170.39 13.01 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 130.354 3.835 . . . . 0.0 112.311 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 19.1 pt -128.49 163.6 32.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 117.938 -1.505 . . . . 0.0 110.994 168.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -83.3 154.74 66.58 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 125.427 1.491 . . . . 0.0 114.7 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . 0.264 32.2 Cg_endo -75.34 -22.59 14.07 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 N-CA-C 121.269 3.526 . . . . 0.0 121.269 -175.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.285 81.3 mttt -142.42 13.3 1.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 124.945 2.307 . . . . 0.0 113.81 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.338 46.3 p -134.11 145.57 49.45 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 131.689 3.996 . . . . 0.0 114.394 177.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -73.17 -11.79 60.65 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.981 2.113 . . . . 0.0 115.337 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -66.13 146.11 55.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 126.893 3.235 . . . . 0.0 111.777 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.4 mtpt -75.27 144.38 42.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 111.973 -2.376 . . . . 0.0 106.162 165.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 63.5 mt -92.1 128.29 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 125.81 1.644 . . . . 0.0 106.597 153.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.72 116.68 29.04 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 165.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.6 mp -91.08 121.74 67.46 Favored Pre-proline 0 N--CA 1.451 -0.391 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -76.04 178.66 7.18 Favored 'Trans proline' 0 N--CA 1.447 -1.245 1 C-N-CA 125.997 4.465 . . . . 0.0 115.287 -175.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -93.52 121.01 34.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.032 2.933 . . . . 0.0 103.946 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.51 154.58 19.66 Favored Glycine 0 C--N 1.341 0.821 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 -178.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -116.22 156.69 26.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.047 2.539 . . . . 0.0 114.091 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 83' ' ' ILE . 7.9 tppt? -161.29 -179.47 7.44 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 HD22 ' A' ' 42' ' ' LEU . 27.4 mm -103.7 146.55 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 105.058 -2.201 . . . . 0.0 105.058 168.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -128.78 133.7 48.15 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.952 2.101 . . . . 0.0 111.447 160.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.7 tp -85.35 143.39 28.68 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 124.289 1.995 . . . . 0.0 109.197 165.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.1 p -129.73 147.7 51.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 110.413 -3.085 . . . . 0.0 104.802 168.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.501 HG11 HD12 ' B' ' 83' ' ' ILE 0.465 0.0 OUTLIER -125.71 133.43 69.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 C-N-CA 128.607 2.763 . . . . 0.0 117.494 -169.194 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.4 t -94.14 142.96 26.8 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 -169.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 93' ' ' ASP . 21.0 pttp -55.85 -12.37 1.32 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 128.568 2.747 . . . . 0.0 115.707 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 91' ' ' LEU . 5.5 tt -54.83 -28.69 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 172.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HG ' HG23 ' A' ' 90' ' ' ILE . 2.1 pp -132.11 19.04 4.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.078 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.8 m -144.13 31.72 1.25 Allowed 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 127.635 2.374 . . . . 0.0 109.055 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 89' ' ' LYS . 5.4 t70 -159.9 106.66 1.63 Allowed 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 171.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.547 . . 84.7 -4.14 0.97 Allowed 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 127.16 2.184 . . . . 0.0 112.41 164.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.47 147.45 8.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 O-C-N 116.953 -3.592 . . . . 0.0 103.664 -162.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.349 59.7 m-20 71.56 -102.13 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 128.153 2.581 . . . . 0.0 107.363 162.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 73.6 p -86.8 -5.49 59.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 123.032 2.651 . . . . 0.0 108.41 -172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -152.72 65.5 0.8 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 123.116 2.689 . . . . 0.0 108.656 -171.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.8 tttt . . . . . 0 C--O 1.251 1.171 0 CA-C-N 110.34 -3.118 . . . . 0.0 113.485 173.521 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ptt? . . . . . 0 N--CA 1.465 0.285 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.31 . . -101.04 129.25 46.87 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -172.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.1 ttmt -79.21 155.1 28.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 104.929 -2.248 . . . . 0.0 104.929 -171.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 pt -112.52 159.52 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 130.544 3.538 . . . . 0.0 110.644 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.447 ' HG3' HD22 ' A' ' 50' ' ' LEU . 70.8 tttt -53.02 -34.11 54.85 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 126.763 2.025 . . . . 0.0 113.992 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 32.5 t -72.3 -34.64 68.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.028 1.731 . . . . 0.0 114.575 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 69.7 mt -81.67 -21.3 38.2 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 114.866 -2.493 . . . . 0.0 110.025 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -84.05 -31.07 25.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.402 1.689 . . . . 0.0 111.051 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.96 -32.07 73.36 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 130.193 3.397 . . . . 0.0 117.576 174.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.65 -18.52 62.85 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 112.023 -2.353 . . . . 0.0 113.248 169.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -92.54 -19.86 21.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 125.997 2.808 . . . . 0.0 113.825 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 7.5 m-85 -75.94 -21.16 57.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 171.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.79 -32.65 74.08 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 126.928 2.091 . . . . 0.0 116.142 167.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -56.76 -39.23 73.63 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.558 2.799 . . . . 0.0 118.558 169.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.35 -29.95 60.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.438 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 3.3 tpt -133.05 49.12 2.34 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 116.848 2.166 . . . . 0.0 116.848 -158.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.298 . . -83.56 -12.92 55.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 123.234 2.743 . . . . 0.0 107.072 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 13.0 t70 83.14 -65.79 0.09 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.77 3.228 . . . . 0.0 107.193 -167.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.251 23.3 tp10 -162.58 -46.58 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.349 1 C-N-CA 135.233 5.413 . . . . 0.0 109.765 164.351 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.397 1.5 t -146.78 -21.68 0.42 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 111.573 -2.558 . . . . 0.0 112.157 167.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -77.47 -18.58 57.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -166.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.517 HD13 HG21 ' B' ' 22' ' ' ILE . 77.6 mt -99.99 118.0 45.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 1 O-C-N 115.55 -4.469 . . . . 0.0 104.411 169.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -97.68 -156.85 0.56 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.586 1.954 . . . . 0.0 107.752 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.4 t -72.48 -46.07 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 O-C-N 120.046 -1.658 . . . . 0.0 107.803 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -76.53 -17.78 59.06 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 126.29 2.947 . . . . 0.0 112.335 -161.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -71.49 -13.39 61.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.874 -2.391 . . . . 0.0 117.017 168.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.8 mm -109.27 -36.56 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 C-N-CA 127.266 2.227 . . . . 0.0 107.753 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -68.02 -35.83 78.93 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 114.721 -2.562 . . . . 0.0 113.872 -172.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 28.9 mt -38.08 -72.03 0.07 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.425 3.49 . . . . 0.0 110.55 158.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.638 HG21 HG11 ' A' ' 30' ' ' VAL . 19.2 t -48.91 -49.39 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.378 2.271 . . . . 0.0 111.791 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.24 -27.04 35.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 C-N-CA 131.208 3.803 . . . . 0.0 112.76 -173.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t -107.45 -28.83 9.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 120.875 1.671 . . . . 0.0 109.903 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 27.9 t -84.34 -34.89 23.56 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 129.277 3.031 . . . . 0.0 115.075 -174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.5 tp -72.47 -34.86 68.01 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 120.258 1.39 . . . . 0.0 110.345 -163.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -58.99 -17.15 22.23 Favored 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 130.051 3.341 . . . . 0.0 116.358 173.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 mmtt -85.3 -36.57 20.76 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 126.082 2.114 . . . . 0.0 112.974 169.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 96.2 t -69.37 -47.07 75.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 128.694 2.798 . . . . 0.0 106.392 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.06 39.98 0.89 Allowed 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 118.528 -2.607 . . . . 0.0 110.647 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -150.35 -62.21 0.2 Allowed 'General case' 0 CA--C 1.517 -0.298 1 C-N-CA 132.906 4.482 . . . . 0.0 113.247 172.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -62.24 -42.6 99.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -73.05 1.36 9.14 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 121.066 1.757 . . . . 0.0 114.721 176.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -101.48 -10.56 20.06 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.881 1.672 . . . . 0.0 113.624 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -33.9 -37.8 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.279 5.031 . . . . 0.0 117.369 171.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 6.5 t -65.68 -12.46 53.73 Favored 'General case' 0 C--N 1.329 -0.306 1 C-N-CA 132.806 4.442 . . . . 0.0 111.491 173.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . 0.453 ' CG2' HG23 ' B' ' 60' ' ' THR 0.27 1.4 m 80.52 71.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.005 -3.56 . . . . 0.0 101.845 -169.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.92 168.65 15.17 Favored Glycine 0 C--N 1.346 1.098 0 C-N-CA 129.036 3.208 . . . . 0.0 115.285 -163.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -129.67 148.25 51.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.972 2.909 . . . . 0.0 110.538 -164.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.2 t -122.11 144.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 129.498 3.119 . . . . 0.0 103.689 -174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -132.39 71.27 1.47 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.993 2.517 . . . . 0.0 112.858 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 20.3 mt -100.1 135.92 40.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.551 2.74 . . . . 0.0 106.621 166.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -70.64 158.46 36.16 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.948 -2.97 . . . . 0.0 114.971 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 t70 82.06 -43.23 0.15 Allowed 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 112.612 -2.085 . . . . 0.0 111.475 161.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 tt -76.59 -30.24 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 124.121 3.146 . . . . 0.0 113.027 173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.01 -154.69 16.81 Favored Glycine 0 C--O 1.226 -0.393 0 C-N-CA 127.919 2.676 . . . . 0.0 109.787 -173.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -116.82 134.01 55.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.795 -0.826 . . . . 0.0 109.486 -173.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -90.37 136.4 33.08 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 171.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.264 41.6 tttt -139.41 141.51 37.52 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 119.846 -1.784 . . . . 0.0 106.604 171.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.77 147.99 48.39 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 101.215 -3.624 . . . . 0.0 101.215 167.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.05 148.75 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 118.576 -2.578 . . . . 0.0 113.645 159.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . 0.453 HG23 ' CG2' ' B' ' 45' ' ' THR . 40.9 p -106.46 137.68 44.01 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.974 2.91 . . . . 0.0 107.795 -170.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.2 m -82.95 149.44 27.02 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.537 1.135 . . . . 0.0 109.719 149.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 35.6 pttt -61.63 128.49 90.25 Favored Pre-proline 0 C--O 1.234 0.287 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -172.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.62 -168.44 0.4 Allowed 'Trans proline' 0 N--CA 1.449 -1.133 0 C-N-CA 123.2 2.6 . . . . 0.0 116.862 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 40.2 ttp85 -162.63 151.23 14.62 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 130.644 3.578 . . . . 0.0 108.857 170.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 9.9 t -131.08 141.06 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.131 -2.231 . . . . 0.0 109.127 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.13 -170.79 12.25 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 103.956 -3.657 . . . . 0.0 103.956 160.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.313 2.6 tt -143.84 137.83 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 128.78 2.832 . . . . 0.0 109.316 -173.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -76.86 127.04 84.9 Favored Pre-proline 0 N--CA 1.446 -0.633 0 C-N-CA 130.938 3.695 . . . . 0.0 108.839 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -81.21 -17.92 8.89 Favored 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 124.335 3.357 . . . . 0.0 116.2 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -96.19 -20.99 18.17 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 128.907 2.883 . . . . 0.0 111.337 -165.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 7.0 t -162.44 149.79 13.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 8.2 tptt -86.48 79.01 9.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 126.854 3.216 . . . . 0.0 109.607 -154.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.95 135.69 27.78 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 119.32 -2.113 . . . . 0.0 113.103 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mtpt -87.04 131.62 34.05 Favored 'General case' 0 N--CA 1.446 -0.626 1 C-N-CA 132.235 4.214 . . . . 0.0 104.681 171.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.7 mt -92.18 118.62 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 103.731 -2.692 . . . . 0.0 103.731 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -87.91 125.05 34.28 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 164.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.2 mt -112.32 129.01 24.75 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 128.454 2.702 . . . . 0.0 105.014 -174.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -89.84 157.21 5.03 Favored 'Trans proline' 0 N--CA 1.441 -1.572 0 C-N-CA 124.238 3.292 . . . . 0.0 111.023 172.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -103.86 -10.39 18.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 128.153 2.581 . . . . 0.0 112.872 159.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.23 150.3 8.32 Favored Glycine 0 N--CA 1.447 -0.613 1 C-N-CA 131.247 4.26 . . . . 0.0 120.573 166.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -120.58 150.1 41.41 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.683 2.793 . . . . 0.0 111.145 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -151.1 162.77 40.24 Favored 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 118.908 -2.37 . . . . 0.0 106.099 174.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 87' ' ' VAL . 14.1 mt -97.81 133.69 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 O-C-N 127.211 2.819 . . . . 0.0 105.226 167.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.54 163.56 14.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.991 170.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 33.4 tp -117.35 138.5 51.74 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 128.994 2.917 . . . . 0.0 109.965 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 12.3 t -125.03 110.68 14.48 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.983 2.113 . . . . 0.0 107.663 162.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 p -71.62 141.07 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 C-N-CA 130.485 3.514 . . . . 0.0 109.924 -160.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -72.15 162.12 29.92 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.697 0.799 . . . . 0.0 112.182 -177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -64.8 -42.33 95.11 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 134.211 5.004 . . . . 0.0 115.042 -165.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 9.1 mm -85.3 -43.41 16.82 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 122.47 1.129 . . . . 0.0 109.434 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 46.0 tp -48.73 -53.63 18.16 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.66 3.584 . . . . 0.0 111.563 164.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.0 t -63.19 -29.13 70.53 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 119.314 -2.116 . . . . 0.0 115.103 -173.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -80.0 -42.17 24.42 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 128.521 2.728 . . . . 0.0 108.534 176.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.27 -10.34 53.96 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -81.46 -34.75 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 121.571 1.987 . . . . 0.0 110.264 166.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -78.2 -51.91 9.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 128.463 2.705 . . . . 0.0 111.088 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 24.1 t -64.05 91.14 0.07 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 131.024 3.729 . . . . 0.0 109.385 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -72.97 116.42 13.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.634 -1.166 . . . . 0.0 113.931 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 ptpt . . . . . 0 C--O 1.246 0.89 0 C-N-CA 130.843 3.657 . . . . 0.0 112.825 171.581 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 N--CA 1.466 0.354 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.45 145.07 27.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 116.313 1.968 . . . . 0.0 116.313 171.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -85.74 155.99 20.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 128.632 2.773 . . . . 0.0 108.014 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.5 tt -136.65 138.84 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 C-N-CA 126.993 2.117 . . . . 0.0 112.229 -172.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 53.8 mmtt -96.66 135.36 38.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 102.762 -3.051 . . . . 0.0 102.762 166.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.3 96.1 p -134.14 170.41 15.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 123.592 1.663 . . . . 0.0 110.594 168.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -147.5 177.67 9.06 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 116.486 -3.884 . . . . 0.0 108.279 -174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.307 11.2 t -146.97 -143.42 0.14 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 117.071 -1.442 . . . . 0.0 107.549 -172.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.41 -32.25 54.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.357 -1.782 . . . . 0.0 107.859 173.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.99 -19.82 7.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -175.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -74.84 -24.86 58.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . 0.336 24.4 t80 -59.13 -26.16 64.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.726 2.81 . . . . 0.0 114.312 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.3 mt -77.12 -11.35 59.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 117.917 -2.989 . . . . 0.0 110.121 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -86.7 -39.63 15.84 Favored 'General case' 0 N--CA 1.452 -0.351 1 O-C-N 114.709 -4.994 . . . . 0.0 108.171 174.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -73.83 -47.18 40.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 105.976 -1.861 . . . . 0.0 105.976 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -96.27 26.65 4.15 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.158 1.783 . . . . 0.0 109.667 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -41.09 -43.08 2.13 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 129.65 3.18 . . . . 0.0 115.46 160.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -75.89 -20.7 57.83 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 128.602 2.761 . . . . 0.0 113.462 -174.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -125.86 37.8 4.28 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.443 2.964 . . . . 0.0 112.871 -175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . 0.397 43.0 p -145.87 75.98 1.44 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 124.884 2.278 . . . . 0.0 112.528 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.288 7.1 p-10 -135.81 -14.36 1.87 Allowed 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 130.133 3.373 . . . . 0.0 112.98 -167.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.296 44.1 pt -123.5 -14.17 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 C-N-CA 126.672 1.989 . . . . 0.0 114.223 167.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.276 36.5 pttt -156.08 154.01 30.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 170.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 p -147.61 -57.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 115.461 -2.209 . . . . 0.0 108.433 -173.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -61.21 -33.17 73.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 119.947 3.314 . . . . 0.0 119.947 177.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -56.78 -30.37 63.58 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 127.894 2.478 . . . . 0.0 116.094 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.438 HD12 ' N ' ' A' ' 27' ' ' ILE . 1.9 mp -63.67 -32.64 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 127.66 2.384 . . . . 0.0 113.052 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 -53.18 -33.53 53.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.311 -2.222 . . . . 0.0 114.276 170.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 24.8 mt -75.99 -32.02 59.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.942 2.097 . . . . 0.0 115.041 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.97 -38.19 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 113.508 -1.678 . . . . 0.0 110.96 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.7 t -57.12 -43.24 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 117.499 2.407 . . . . 0.0 117.499 165.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -76.85 -40.71 46.83 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.411 3.484 . . . . 0.0 106.815 -172.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 51.8 p -81.24 -24.96 37.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 123.825 3.012 . . . . 0.0 114.098 -173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -43.73 -42.17 5.26 Favored 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 134.455 5.102 . . . . 0.0 111.099 164.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -81.49 -35.04 30.92 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 126.291 2.948 . . . . 0.0 112.939 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -61.98 -62.48 1.76 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.153 2.581 . . . . 0.0 106.498 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 88.5 t -49.11 -48.44 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 128.862 2.865 . . . . 0.0 112.032 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.06 -57.31 13.65 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.78 2.032 . . . . 0.0 108.829 -175.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.07 1.53 2.71 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.796 3.238 . . . . 0.0 111.621 -168.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -76.52 -39.48 52.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 124.958 1.411 . . . . 0.0 107.343 169.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -70.18 -36.31 74.55 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.107 1.763 . . . . 0.0 112.157 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.4 mt -76.72 -32.74 58.01 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 128.34 2.656 . . . . 0.0 111.551 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.3 6.27 3.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 129.553 3.141 . . . . 0.0 114.841 165.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.404 52.5 p -116.95 10.11 13.94 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 124.205 0.941 . . . . 0.0 113.013 163.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.309 26.3 m 67.02 70.92 0.38 Allowed 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 124.689 2.185 . . . . 0.0 109.741 172.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.13 122.36 5.3 Favored Glycine 0 C--N 1.34 0.786 1 C-N-CA 130.994 4.14 . . . . 0.0 111.483 -174.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -79.51 63.61 4.16 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.023 2.929 . . . . 0.0 108.972 168.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.4 t -60.38 118.56 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 126.525 1.93 . . . . 0.0 109.306 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.2 ttp85 -116.3 111.79 20.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.453 2.346 . . . . 0.0 109.83 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.3 mt -101.21 112.22 24.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.673 -2.517 . . . . 0.0 116.564 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -67.2 115.73 7.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.612 0.1 OUTLIER 96.0 9.22 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.635 3.084 . . . . 0.0 118.392 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.401 0.6 OUTLIER -131.14 -53.2 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 O-C-N 119.034 -2.291 . . . . 0.0 106.24 -176.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.33 -138.52 9.58 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 129.106 3.241 . . . . 0.0 107.23 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.328 83.1 tttt -149.36 147.19 28.01 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 114.3 -0.95 . . . . 0.0 112.062 -165.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.287 95.7 m-85 -95.49 122.44 38.22 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 157.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -97.51 131.25 44.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.953 2.901 . . . . 0.0 107.151 166.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.99 93.27 4.78 Favored 'General case' 0 N--CA 1.449 -0.5 1 N-CA-C 99.855 -4.128 . . . . 0.0 99.855 168.688 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -77.57 169.15 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 128.31 3.506 . . . . 0.0 111.09 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.3 t -158.35 143.31 16.35 Favored 'General case' 0 C--N 1.342 0.26 0 C-N-CA 116.872 -1.931 . . . . 0.0 105.868 -161.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.0 p -102.13 131.44 48.63 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 130.908 3.683 . . . . 0.0 106.512 164.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -83.93 166.5 33.41 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 115.676 -2.107 . . . . 0.0 112.36 -168.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -80.72 146.2 16.57 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 CA-C-N 121.514 1.577 . . . . 0.0 111.747 172.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.463 HH11 ' HD2' ' A' ' 64' ' ' ARG . 45.1 mtm180 -141.34 165.91 26.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 -170.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.276 7.3 t -142.2 -172.04 3.51 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 127.432 2.293 . . . . 0.0 108.349 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.27 -160.54 26.84 Favored Glycine 0 C--N 1.337 0.637 0 C-N-CA 126.765 2.126 . . . . 0.0 110.947 -169.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 35.5 mt -136.4 137.05 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.338 3.455 . . . . 0.0 105.52 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -76.29 159.83 79.16 Favored Pre-proline 0 N--CA 1.446 -0.635 0 CA-C-O 123.278 1.513 . . . . 0.0 110.783 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -82.0 -26.7 2.8 Favored 'Trans proline' 0 N--CA 1.455 -0.773 1 C-N-CA 125.779 4.319 . . . . 0.0 115.873 -168.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 mttt -128.03 9.73 6.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.05 2.14 . . . . 0.0 109.729 -175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 28.1 p -136.87 152.14 49.9 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 118.995 -2.316 . . . . 0.0 107.509 166.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 ttpt -93.86 6.58 47.96 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 114.892 -2.48 . . . . 0.0 107.949 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -75.28 164.06 26.83 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 123.185 2.72 . . . . 0.0 112.92 169.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -78.98 149.18 32.33 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 112.977 -1.92 . . . . 0.0 106.199 -170.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.9 mt -89.12 131.85 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 164.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -134.29 90.78 2.72 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.538 -2.393 . . . . 0.0 104.538 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 91.7 mt -93.61 120.76 65.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 104.784 -2.302 . . . . 0.0 104.784 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . 0.26 16.3 Cg_endo -80.51 176.8 8.78 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 O-C-N 125.085 2.097 . . . . 0.0 114.996 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . 0.262 . . -77.56 138.53 39.22 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.857 1.663 . . . . 0.0 110.966 164.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.95 159.08 15.1 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 103.473 -3.851 . . . . 0.0 103.473 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -133.87 156.16 48.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.535 1.934 . . . . 0.0 107.038 163.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -145.43 134.07 22.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 114.18 -2.819 . . . . 0.0 111.767 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.4 mt -79.99 135.99 24.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 100.686 -3.82 . . . . 0.0 100.686 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -131.43 109.31 10.22 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 104.624 -2.362 . . . . 0.0 104.624 177.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 11.0 tp -70.87 140.21 51.03 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 168.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 81.3 p -128.85 158.81 37.69 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.106 2.162 . . . . 0.0 105.511 169.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -136.1 139.06 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 125.754 1.909 . . . . 0.0 110.35 -168.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 t -93.67 140.27 29.83 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.986 1.314 . . . . 0.0 108.187 -168.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -42.69 -20.32 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.826 1 C-N-CA 132.254 4.222 . . . . 0.0 117.565 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 tt -65.74 -20.58 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 C-N-CA 128.158 2.583 . . . . 0.0 109.61 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.36 1.6 pp -132.32 13.46 4.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 176.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.459 9.8 t -144.1 7.94 1.41 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 119.264 -2.147 . . . . 0.0 112.881 -178.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.59 17.5 t70 -137.47 91.71 2.63 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 123.877 3.035 . . . . 0.0 112.223 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.14 31.59 2.43 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.729 1.252 . . . . 0.0 112.591 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.1 p -175.44 141.11 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.986 1 C-N-CA 133.074 4.549 . . . . 0.0 108.549 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.376 84.8 m-20 77.25 -90.18 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 129.915 3.286 . . . . 0.0 112.146 160.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.0 p -86.38 -27.86 23.96 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 126.495 2.372 . . . . 0.0 111.237 -170.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 25.0 t60 -132.52 106.16 7.67 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 102.508 -3.145 . . . . 0.0 102.508 165.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.9 tttt . . . . . 0 C--O 1.244 0.801 0 C-N-CA 126.665 1.986 . . . . 0.0 107.676 166.485 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 32.4 ttm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 121.578 0.704 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.94 56.84 0.2 Allowed 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 131.107 3.763 . . . . 0.0 110.973 164.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -69.17 152.24 45.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -156.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 pt -101.84 155.03 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.491 2.716 . . . . 0.0 112.362 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -53.41 -44.32 68.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 129.329 3.051 . . . . 0.0 114.955 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . 0.396 32.7 t -40.1 -58.3 1.48 Allowed 'General case' 0 N--CA 1.451 -0.388 1 C-N-CA 132.412 4.285 . . . . 0.0 114.92 166.595 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.6 -34.2 27.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.084 -2.885 . . . . 0.0 111.001 -173.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -54.55 -54.95 34.44 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 129.415 3.086 . . . . 0.0 108.967 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.19 -9.02 0.23 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.613 2.819 . . . . 0.0 118.613 168.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.32 -22.56 15.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 127.897 2.479 . . . . 0.0 112.091 173.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -89.19 -15.93 32.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 117.673 -3.142 . . . . 0.0 112.228 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -78.65 -17.09 56.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 117.44 -3.288 . . . . 0.0 109.817 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.26 -20.88 61.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 127.682 2.393 . . . . 0.0 110.567 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -99.87 -4.49 30.24 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -104.23 -46.82 4.31 Favored 'General case' 0 N--CA 1.451 -0.399 1 O-C-N 115.934 -4.229 . . . . 0.0 111.519 -170.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 mtp -122.68 100.32 6.86 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 115.744 -2.074 . . . . 0.0 110.384 172.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -150.81 -63.75 0.19 Allowed 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 128.235 3.459 . . . . 0.0 118.013 -173.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 15.7 t70 79.52 -85.1 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.196 3.399 . . . . 0.0 103.642 -175.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -134.25 -56.51 0.86 Allowed 'General case' 0 N--CA 1.451 -0.391 1 C-N-CA 132.488 4.315 . . . . 0.0 105.441 163.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.478 2.7 t -145.22 -0.84 0.86 Allowed 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 118.605 -2.56 . . . . 0.0 112.466 -171.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.03 -53.27 32.86 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 117.469 -3.27 . . . . 0.0 116.785 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.489 ' N ' HD12 ' B' ' 22' ' ' ILE . 3.6 mp -85.83 115.33 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 103.493 -2.781 . . . . 0.0 103.493 167.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -80.71 176.98 9.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.081 1.896 . . . . 0.0 107.078 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 50.2 t -65.56 -50.17 73.57 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 O-C-N 118.065 -2.897 . . . . 0.0 110.35 171.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -78.81 -13.15 59.97 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 125.182 1.393 . . . . 0.0 112.546 -175.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -65.6 -18.93 65.68 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 160.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.26 -49.98 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 C-N-CA 124.32 1.048 . . . . 0.0 108.82 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -58.22 -24.42 59.12 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 119.165 -2.209 . . . . 0.0 112.791 -168.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.334 12.2 tp -83.11 -38.78 21.99 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 124.396 1.06 . . . . 0.0 108.164 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 47.9 t -56.03 -40.74 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.831 2.452 . . . . 0.0 111.381 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 t -66.0 -2.38 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 C-N-CA 133.732 4.813 . . . . 0.0 114.774 175.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -140.48 38.07 1.87 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 106.869 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 3.5 t -160.65 -33.2 0.05 Allowed 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.403 -0.811 . . . . 0.0 112.209 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 38.2 tp -73.74 -21.65 60.13 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.406 0.548 . . . . 0.0 110.744 -173.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -61.44 -21.69 64.37 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 130.199 3.4 . . . . 0.0 112.85 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . 0.338 29.6 mmmt -91.46 -38.14 12.74 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 126.563 2.414 . . . . 0.0 108.182 -171.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 37.3 t -65.59 -29.71 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 C-N-CA 127.257 2.223 . . . . 0.0 109.575 166.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.8 33.2 0.78 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 124.357 3.253 . . . . 0.0 112.553 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -153.5 -61.26 0.14 Allowed 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 112.496 -3.621 . . . . 0.0 108.904 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . 0.255 23.9 mttt -66.06 -46.74 76.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 127.252 2.845 . . . . 0.0 114.88 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.255 63.7 mm-40 -80.14 -9.35 59.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.615 -2.553 . . . . 0.0 111.294 -167.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.71 HD21 HG23 ' B' ' 48' ' ' VAL . 16.4 mt -81.63 -22.91 37.31 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.419 1.888 . . . . 0.0 111.106 176.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.58 -18.34 19.17 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 128.536 2.735 . . . . 0.0 118.206 -166.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 15.1 t -67.64 -15.3 63.58 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 120.023 -1.673 . . . . 0.0 115.155 169.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.533 36.7 p 89.52 51.38 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.714 1 C-N-CA 132.795 4.438 . . . . 0.0 112.172 -162.56 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.65 -154.81 24.05 Favored Glycine 0 N--CA 1.441 -1.024 0 O-C-N 120.36 -1.462 . . . . 0.0 110.366 -171.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -171.27 136.74 1.06 Allowed 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -165.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.71 HG23 HD21 ' B' ' 42' ' ' LEU . 3.7 t -111.28 113.23 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.828 0 CA-C-O 124.065 1.888 . . . . 0.0 106.396 173.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -78.32 89.24 4.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 129.881 3.272 . . . . 0.0 105.496 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.5 mt -106.86 176.01 5.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.228 -2.17 . . . . 0.0 111.332 169.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -126.5 135.95 51.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 124.801 2.239 . . . . 0.0 114.068 -169.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.39 1.1 t70 92.31 -36.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 130.166 3.386 . . . . 0.0 113.869 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.24 -21.24 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 117.184 2.29 . . . . 0.0 117.184 -176.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.96 -161.4 12.99 Favored Glycine 0 C--N 1.343 0.95 1 N-CA-C 102.76 -4.136 . . . . 0.0 102.76 -170.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -122.89 154.98 37.6 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 123.737 0.815 . . . . 0.0 111.658 -173.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -101.92 133.29 46.94 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 174.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -142.58 149.43 39.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.1 2.16 . . . . 0.0 110.243 -177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 tp -78.85 152.57 31.2 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.424 2.69 . . . . 0.0 108.76 171.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.03 143.83 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 165.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 66.6 p -108.48 165.91 11.17 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.128 -1.396 . . . . 0.0 109.732 -177.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 99.5 m -109.6 140.43 43.43 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 126.453 1.901 . . . . 0.0 113.484 130.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.404 ' HB2' ' HD2' ' B' ' 63' ' ' PRO . 16.7 pttt -67.43 154.74 92.49 Favored Pre-proline 0 N--CA 1.445 -0.696 0 C-N-CA 124.06 0.944 . . . . 0.0 111.665 -175.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 62' ' ' LYS 0.288 30.2 Cg_endo -82.6 157.2 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.273 0 C-N-CA 124.509 3.472 . . . . 0.0 113.56 -175.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 36.5 ttp85 -87.2 146.08 26.14 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.316 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.332 11.8 t -139.78 -153.22 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -163.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.44 16.65 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 129.098 3.237 . . . . 0.0 111.003 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 40.6 mm -108.01 128.51 63.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 C-N-CA 126.565 1.946 . . . . 0.0 107.009 -174.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -63.21 124.22 83.27 Favored Pre-proline 0 N--CA 1.44 -0.951 0 C-N-CA 126.903 2.081 . . . . 0.0 113.185 170.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -83.84 -15.54 6.98 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-O 112.95 -3.021 . . . . 0.0 114.804 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 tttp -95.17 -15.42 23.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 125.932 2.02 . . . . 0.0 112.825 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 14.4 t -156.66 139.54 15.26 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -67.09 69.3 0.08 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 129.084 2.953 . . . . 0.0 116.882 -165.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -154.78 160.52 41.35 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 -168.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.2 tttt -92.52 141.64 28.28 Favored 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 132.87 4.468 . . . . 0.0 103.531 177.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 6.2 mt -110.73 140.13 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 O-C-N 127.918 3.261 . . . . 0.0 102.494 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -127.5 118.17 23.51 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.102 2.961 . . . . 0.0 109.488 155.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -98.7 126.47 38.8 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-O 113.091 -3.337 . . . . 0.0 105.642 168.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.03 160.17 33.56 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 CA-C-N 126.892 3.497 . . . . 0.0 113.367 175.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -89.26 -29.73 19.01 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 130.754 3.622 . . . . 0.0 111.057 171.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.47 162.1 11.21 Favored Glycine 0 N--CA 1.446 -0.695 0 O-C-N 127.116 2.76 . . . . 0.0 108.972 176.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -148.0 132.84 18.02 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 126.288 1.835 . . . . 0.0 108.566 172.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -130.03 -162.06 1.17 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.365 1.466 . . . . 0.0 110.517 -175.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 4.6 mt -122.14 146.6 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 104.721 -2.326 . . . . 0.0 104.721 -172.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.6 164.71 19.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 126.909 2.631 . . . . 0.0 110.466 160.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.65 165.18 12.45 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.856 158.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.295 1.9 t -144.79 108.26 4.63 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.985 167.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.5 p -46.36 139.25 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.459 1 C-N-CA 132.959 4.503 . . . . 0.0 117.011 -176.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 63.0 p -77.52 164.94 24.95 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.544 3.538 . . . . 0.0 111.936 172.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -64.57 -39.47 93.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.35 -48.18 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 O-C-N 117.016 -3.553 . . . . 0.0 107.288 -167.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 27.9 tp -79.28 -40.64 29.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.181 -1.866 . . . . 0.0 107.517 -170.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.1 t -61.93 -47.3 85.51 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 123.501 2.864 . . . . 0.0 109.746 -174.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -66.49 -22.27 66.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 127.174 2.189 . . . . 0.0 110.865 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.12 -22.3 28.93 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.058 -1.925 . . . . 0.0 115.746 174.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 59.4 t -91.19 -27.3 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 121.174 1.806 . . . . 0.0 111.373 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.72 -24.19 66.92 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.59 1.556 . . . . 0.0 111.667 168.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 25.1 t -73.86 109.13 7.12 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 130.33 3.452 . . . . 0.0 102.201 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -82.91 108.08 15.98 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 172.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 15.3 pttp . . . . . 0 C--O 1.252 1.2 0 C-N-CA 130.295 3.438 . . . . 0.0 106.777 172.109 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.347 7.2 ttt . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.0 133.53 51.0 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.606 1.562 . . . . 0.0 115.082 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.53 176.57 6.41 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 122.194 2.27 . . . . 0.0 111.259 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.6 mt -81.48 149.03 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-O 116.366 -1.778 . . . . 0.0 112.663 166.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -86.27 116.17 24.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 116.885 -1.531 . . . . 0.0 110.91 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . 0.284 70.5 m -72.24 133.01 44.83 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 128.635 2.774 . . . . 0.0 107.129 163.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.97 179.45 8.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 130.254 3.422 . . . . 0.0 109.223 166.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.0 t -161.81 -133.88 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 126.847 2.592 . . . . 0.0 114.08 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.58 -26.84 37.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 125.935 2.779 . . . . 0.0 112.254 -165.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -38.17 75.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.617 -1.927 . . . . 0.0 114.918 171.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.37 -18.6 51.31 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 120.4 3.482 . . . . 0.0 120.4 178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.59 -29.84 71.04 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 113.477 -1.692 . . . . 0.0 113.61 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -68.64 -18.42 64.29 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 117.55 -3.219 . . . . 0.0 113.152 -171.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -78.77 -8.72 59.02 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.807 1.643 . . . . 0.0 112.488 174.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.28 5.1 tp10 -106.74 -11.4 15.81 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.272 -2.142 . . . . 0.0 112.647 168.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 15.3 ttt -103.52 3.89 35.26 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 128.885 2.874 . . . . 0.0 112.23 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.46 -6.47 1.6 Allowed 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 134.188 4.995 . . . . 0.0 115.832 -165.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.25 -2.12 58.42 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 126.86 2.6 . . . . 0.0 110.834 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.79 59.11 1.19 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 124.102 3.137 . . . . 0.0 108.856 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -131.23 64.92 1.57 Allowed 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 130.676 3.59 . . . . 0.0 107.39 174.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.423 12.4 p30 -132.68 -51.78 0.92 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.726 2.41 . . . . 0.0 116.653 -172.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.8 pt -89.0 -8.44 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-N 121.331 1.878 . . . . 0.0 111.834 175.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -152.61 151.93 31.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.35 2.66 . . . . 0.0 111.052 174.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.359 6.3 p -143.8 -46.27 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 C-N-CA 129.867 3.267 . . . . 0.0 117.884 -176.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -92.9 -19.44 21.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -70.16 -33.96 72.42 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 123.023 1.392 . . . . 0.0 112.297 -176.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.9 mt -51.76 -21.03 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 O-C-N 118.397 -2.689 . . . . 0.0 115.096 169.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 mtm180 -66.28 -32.78 74.4 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 117.786 -3.072 . . . . 0.0 114.509 170.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.418 ' HB3' HD11 ' B' ' 22' ' ' ILE . 4.7 mp -81.88 -15.8 52.81 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 128.299 2.64 . . . . 0.0 109.315 176.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.71 -44.09 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 121.511 1.959 . . . . 0.0 106.425 170.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 27' ' ' ILE . 91.2 t -64.14 -35.66 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 1 O-C-N 115.366 -4.584 . . . . 0.0 107.149 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 m -70.48 -23.22 62.64 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 127.396 2.279 . . . . 0.0 111.459 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.6 p -66.81 -32.31 73.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 124.744 3.429 . . . . 0.0 115.805 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -76.23 -35.55 58.95 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 128.221 3.867 . . . . 0.0 111.926 -172.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -58.64 -39.18 79.83 Favored 'General case' 0 N--CA 1.45 -0.448 1 C-N-CA 132.489 4.315 . . . . 0.0 113.87 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -77.1 -25.54 52.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 112.363 -2.198 . . . . 0.0 110.724 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.571 HG21 ' HD1' ' B' ' 12' ' ' TYR . 71.9 t -80.24 -29.01 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 116.581 -1.676 . . . . 0.0 115.352 169.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.34 -52.53 46.15 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 123.901 3.046 . . . . 0.0 112.885 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.84 -32.24 60.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 175.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -79.49 -42.02 26.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.756 2.022 . . . . 0.0 106.936 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -68.63 -40.49 80.28 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 126.843 2.057 . . . . 0.0 110.18 -174.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 mt -75.38 -33.48 61.03 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 126.131 2.144 . . . . 0.0 116.132 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.36 -5.37 52.04 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 114.847 -2.502 . . . . 0.0 109.453 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.3 p -108.05 17.47 22.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 123.69 2.95 . . . . 0.0 110.085 168.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.277 5.7 m 64.84 40.44 5.49 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 129.447 3.099 . . . . 0.0 114.981 174.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.11 137.89 14.53 Favored Glycine 0 C--O 1.221 -0.677 0 C-N-CA 127.224 2.345 . . . . 0.0 109.23 175.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -86.47 125.69 33.9 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 127.638 2.375 . . . . 0.0 106.882 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.1 t -104.93 102.93 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 O-C-N 126.763 2.539 . . . . 0.0 110.383 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtt180 -81.06 136.39 35.95 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.9 mt -133.31 78.46 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 1 N-CA-C 98.092 -4.781 . . . . 0.0 98.092 172.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -63.98 124.5 21.73 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.476 -2.015 . . . . 0.0 110.631 -174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.4 0.0 OUTLIER 100.95 -8.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 1 C-N-CA 131.963 4.105 . . . . 0.0 111.986 -169.628 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mt -98.9 -41.98 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 O-C-N 117.428 -3.295 . . . . 0.0 111.157 155.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.1 -168.34 14.16 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 124.636 2.242 . . . . 0.0 108.978 -158.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -133.28 147.06 51.9 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 120.336 -1.685 . . . . 0.0 110.817 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -93.18 107.89 19.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 102.05 -3.315 . . . . 0.0 102.05 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -89.52 129.73 35.95 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 127.704 2.402 . . . . 0.0 108.228 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 46.1 mt -92.08 146.44 23.73 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 118.39 -2.694 . . . . 0.0 108.163 167.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.26 152.84 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 1 C-N-CA 132.176 4.19 . . . . 0.0 109.66 166.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.0 t -127.06 117.91 23.38 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -165.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.8 p -88.85 144.22 26.36 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 124.65 1.18 . . . . 0.0 108.964 -169.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.0 pttt -82.01 156.51 69.6 Favored Pre-proline 0 C--O 1.224 -0.252 0 O-C-N 121.478 -0.764 . . . . 0.0 112.558 -169.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.02 168.7 23.25 Favored 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 121.915 1.743 . . . . 0.0 110.813 171.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -153.9 169.88 22.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 125.368 2.508 . . . . 0.0 107.081 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.365 8.5 t -135.84 137.26 41.33 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.362 -1.744 . . . . 0.0 112.309 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.68 172.08 14.69 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-O 124.744 2.302 . . . . 0.0 107.393 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 mt -129.89 146.53 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 1 O-C-N 115.228 -4.69 . . . . 0.0 105.842 173.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -85.66 166.23 31.03 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 123.449 0.7 . . . . 0.0 111.0 -176.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -86.61 -43.87 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 CA-C-N 120.731 1.297 . . . . 0.0 112.384 -169.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.2 mttp -94.13 -12.47 28.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 117.375 -3.328 . . . . 0.0 114.521 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.8 p -130.83 148.23 52.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 128.699 2.8 . . . . 0.0 107.928 -174.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . 0.302 76.3 mttt -78.79 -1.41 34.67 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 120.095 -1.628 . . . . 0.0 112.072 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -40.9 127.7 2.63 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.112 3.004 . . . . 0.0 119.112 170.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -70.92 149.51 46.65 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 128.346 2.659 . . . . 0.0 114.932 -177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.8 mt -126.85 143.27 40.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 113.122 -1.854 . . . . 0.0 106.169 168.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -113.22 129.05 56.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.696 2.398 . . . . 0.0 105.481 172.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.6 123.92 37.89 Favored Pre-proline 0 N--CA 1.443 -0.824 0 N-CA-C 100.659 -3.83 . . . . 0.0 100.659 173.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -68.34 160.1 50.49 Favored 'Trans proline' 0 N--CA 1.452 -0.955 1 C-N-CA 127.055 5.17 . . . . 0.0 114.585 173.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.34 130.36 37.03 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 131.243 3.817 . . . . 0.0 110.51 170.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.48 -170.88 14.99 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 130.494 3.902 . . . . 0.0 110.759 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.0 pttp -163.53 161.96 24.29 Favored 'General case' 0 N--CA 1.445 -0.707 0 O-C-N 120.342 -1.681 . . . . 0.0 109.849 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.6 pttt -160.47 157.64 27.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.573 1.549 . . . . 0.0 110.02 -164.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.0 mt -84.83 154.5 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 CA-C-O 123.681 1.705 . . . . 0.0 112.641 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.256 13.9 ptmt -137.46 144.27 42.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 158.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.8 tp -96.44 118.51 33.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.422 -3.924 . . . . 0.0 106.259 -173.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.0 p -105.69 109.35 21.28 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 122.235 2.289 . . . . 0.0 108.772 167.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.97 142.06 19.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 120.232 -1.542 . . . . 0.0 109.882 -177.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.9 t -83.36 151.11 25.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.501 2.096 . . . . 0.0 112.365 -168.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.321 58.8 pttt -35.31 -30.73 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 120.458 3.503 . . . . 0.0 120.458 168.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . 0.298 6.2 tp -77.27 -0.91 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 127.065 2.146 . . . . 0.0 113.511 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.39 0.6 OUTLIER -139.16 21.53 2.6 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.904 -1.522 . . . . 0.0 114.249 157.24 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 2.3 t -155.87 14.04 0.34 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 123.074 2.67 . . . . 0.0 113.121 175.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.28 15.3 t70 -121.15 96.25 5.02 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.145 -5.347 . . . . 0.0 110.048 174.122 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 62.9 22.08 13.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.227 2.611 . . . . 0.0 113.926 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.2 p -150.13 141.91 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 C-N-CA 128.173 2.589 . . . . 0.0 111.397 -177.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 60.46 -94.21 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 172.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 p -79.73 -30.17 40.81 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.5 t60 -125.58 98.03 5.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 171.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 55.4 tttt . . . . . 0 C--O 1.249 1.066 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 178.828 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ttt . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 115.472 -2.204 . . . . 0.0 109.288 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.86 147.09 26.97 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.107 2.754 . . . . 0.0 113.301 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -128.96 166.28 19.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 125.195 1.559 . . . . 0.0 113.356 170.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 20.4 pt -127.14 151.88 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 129.54 3.136 . . . . 0.0 110.691 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -55.34 -35.17 64.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 119.817 3.266 . . . . 0.0 119.817 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.9 p -60.99 -32.21 71.79 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.418 2.687 . . . . 0.0 111.996 177.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.29 -25.1 16.47 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.122 2.169 . . . . 0.0 107.19 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.7 t -62.34 -50.55 71.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.669 -1.157 . . . . 0.0 110.414 173.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.509 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -70.54 -29.68 66.21 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.787 2.435 . . . . 0.0 109.702 -171.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.83 85.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 123.085 1.421 . . . . 0.0 114.667 173.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -76.2 -31.28 58.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 118.165 -2.834 . . . . 0.0 109.028 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.571 ' HD1' HG21 ' A' ' 37' ' ' VAL . 16.6 m-30 -49.04 -42.87 39.79 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 129.729 3.212 . . . . 0.0 110.45 -176.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.88 -33.37 75.44 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.342 1.057 . . . . 0.0 112.081 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -88.3 -22.61 23.78 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 130.466 3.507 . . . . 0.0 111.35 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -81.04 -38.38 27.53 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.654 1.182 . . . . 0.0 112.935 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.3 ttt -149.12 125.58 10.94 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.86 -40.31 0.41 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.468 3.107 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.272 38.9 t70 85.06 -124.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.713 1 C-N-CA 134.334 5.053 . . . . 0.0 104.725 -166.781 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.77 -48.38 25.79 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 117.963 -2.961 . . . . 0.0 108.552 151.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.8 t 179.43 33.6 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.498 1 C-N-CA 131.82 4.048 . . . . 0.0 110.713 -174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -87.5 -23.79 24.3 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.549 -3.844 . . . . 0.0 116.299 174.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 29' ' ' LEU . 4.2 mp -92.22 109.5 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 1 N-CA-C 97.999 -4.815 . . . . 0.0 97.999 159.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . 0.25 66.7 mttm -100.64 169.63 8.9 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.76 -1.838 . . . . 0.0 111.387 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -73.55 -45.59 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-O 126.887 3.232 . . . . 0.0 106.283 -169.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -59.05 -6.85 0.92 Allowed 'General case' 0 CA--C 1.514 -0.421 1 O-C-N 114.792 -4.943 . . . . 0.0 119.826 167.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -87.69 -54.32 4.32 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.922 -1.736 . . . . 0.0 109.143 169.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 10.7 mt -50.78 -40.53 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 119.474 -2.016 . . . . 0.0 115.982 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.321 36.4 ttm180 -48.85 -24.06 1.31 Allowed 'General case' 0 N--CA 1.452 -0.342 1 C-N-CA 134.699 5.2 . . . . 0.0 115.815 175.04 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 8.7 mp -102.04 -34.4 9.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.588 1.155 . . . . 0.0 108.731 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.71 -53.36 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 C-N-CA 131.423 3.889 . . . . 0.0 109.021 -172.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.269 9.2 p -45.43 -31.53 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 1 C-N-CA 132.935 4.494 . . . . 0.0 113.294 178.661 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.361 5.5 t -123.7 43.39 2.98 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 119.129 0.877 . . . . 0.0 112.384 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.7 t -161.64 -44.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 O-C-N 119.321 -2.112 . . . . 0.0 108.947 -170.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 34' ' ' LEU . 25.6 tp -51.11 -53.07 37.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.54 2.736 . . . . 0.0 110.803 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -49.94 -41.18 45.8 Favored 'General case' 0 N--CA 1.45 -0.429 1 C-N-CA 135.336 5.454 . . . . 0.0 111.697 -177.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -80.05 -42.51 23.59 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 113.346 -1.752 . . . . 0.0 114.192 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.38 -51.68 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 118.046 -1.461 . . . . 0.0 114.642 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 30.2 mt -68.8 0.83 3.85 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 116.015 -1.945 . . . . 0.0 110.962 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -93.52 -49.61 5.82 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 114.217 -2.801 . . . . 0.0 110.843 160.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -53.47 -48.52 68.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.936 3.062 . . . . 0.0 109.384 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . 0.289 68.4 mm-40 -73.1 -3.72 28.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 125.336 2.493 . . . . 0.0 113.91 -170.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 50.9 mt -89.13 -18.57 26.93 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 117.442 -3.286 . . . . 0.0 117.52 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.75 69.7 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.876 2.07 . . . . 0.0 111.762 -170.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.313 14.8 t -37.7 -8.6 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 130.9 3.68 . . . . 0.0 117.057 160.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.418 11.8 p 70.77 77.38 0.18 Allowed 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 124.204 3.184 . . . . 0.0 107.274 -152.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -106.89 164.2 13.28 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.215 1.864 . . . . 0.0 114.848 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -122.23 117.88 27.22 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 159.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -89.46 119.54 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 121.294 1.861 . . . . 0.0 107.75 161.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -103.18 127.8 50.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 131.575 3.95 . . . . 0.0 102.133 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.293 89.1 mt -133.48 131.76 40.24 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.117 2.167 . . . . 0.0 109.962 -176.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -64.48 140.05 58.83 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 118.765 2.876 . . . . 0.0 118.765 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.467 31.0 m-20 84.02 -51.62 0.13 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 108.884 -3.78 . . . . 0.0 113.567 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 5.9 tp -63.43 -59.18 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 C-N-CA 130.605 3.562 . . . . 0.0 112.61 -175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.71 -158.02 22.63 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 126.805 2.145 . . . . 0.0 109.87 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -112.06 134.54 53.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 101.902 -3.369 . . . . 0.0 101.902 -164.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -97.22 150.29 21.07 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 165.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -157.5 140.21 14.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 126.525 2.391 . . . . 0.0 106.221 -162.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.602 HD21 ' HD2' ' B' ' 81' ' ' LYS 0.266 14.3 tp -88.79 145.94 25.3 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.201 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.259 7.7 p -139.26 148.34 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 C-N-CA 126.624 1.97 . . . . 0.0 106.11 167.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 27.2 p -122.34 137.13 54.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.918 3.287 . . . . 0.0 108.199 -164.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 67.3 m -74.84 149.53 39.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -52.18 157.08 2.41 Favored Pre-proline 0 N--CA 1.442 -0.862 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.4 155.93 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.38 0 C-N-CA 122.183 1.922 . . . . 0.0 109.661 -174.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -80.1 125.01 29.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 151.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.385 12.1 t -136.17 -160.29 1.04 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.101 1.76 . . . . 0.0 111.279 -177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.0 -176.72 19.14 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 125.38 1.467 . . . . 0.0 113.53 -164.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.6 mm -99.27 134.32 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 101.332 -3.581 . . . . 0.0 101.332 163.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -77.67 139.32 62.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 113.826 -2.988 . . . . 0.0 112.259 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -81.51 -34.61 0.51 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.154 2.569 . . . . 0.0 117.496 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -83.06 -20.15 35.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 122.724 2.511 . . . . 0.0 116.079 -175.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.306 14.3 t -149.49 155.17 39.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 115.502 -2.189 . . . . 0.0 110.766 168.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -73.35 90.02 1.64 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 129.162 2.985 . . . . 0.0 113.605 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -167.19 168.1 13.75 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 129.604 3.161 . . . . 0.0 115.308 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -96.25 134.46 39.33 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 32.3 mt -75.24 139.51 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.62 2.368 . . . . 0.0 107.407 173.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -145.75 64.65 1.24 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.707 2.403 . . . . 0.0 114.661 -167.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.13 122.54 41.15 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 117.06 -1.447 . . . . 0.0 109.364 -167.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -78.67 164.27 25.9 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 C-N-CA 122.362 2.041 . . . . 0.0 111.964 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.252 . . -135.03 -2.39 2.57 Favored 'General case' 0 N--CA 1.446 -0.673 2 C-N-CA 134.121 4.968 . . . . 0.0 115.095 -160.391 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.03 167.9 16.27 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 128.725 3.06 . . . . 0.0 111.472 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.602 ' HD2' HD21 ' B' ' 58' ' ' LEU . 28.9 pttt -160.66 163.68 32.32 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 124.987 2.327 . . . . 0.0 108.66 -170.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -164.22 139.18 5.82 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.091 2.156 . . . . 0.0 108.968 -165.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.448 ' H ' HG13 ' B' ' 83' ' ' ILE . 7.5 mt -60.09 118.75 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 127.613 2.365 . . . . 0.0 111.762 160.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -114.17 143.71 44.38 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 129.201 3.0 . . . . 0.0 112.279 171.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.65 156.0 26.56 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.961 2.663 . . . . 0.0 110.381 170.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.417 9.9 t -140.09 97.23 3.19 Favored 'General case' 0 N--CA 1.45 -0.471 1 N-CA-C 98.254 -4.721 . . . . 0.0 98.254 161.549 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.253 9.0 p -64.69 150.23 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 1 C-N-CA 133.119 4.568 . . . . 0.0 105.419 -169.392 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 47.4 t -56.37 142.96 36.23 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 164.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 44.4 tttm -51.13 -47.86 61.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 128.392 2.677 . . . . 0.0 107.15 167.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.631 HD12 ' H ' ' B' ' 90' ' ' ILE 0.288 3.8 mp -70.82 -35.74 61.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 117.247 -1.359 . . . . 0.0 110.992 -173.147 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 24.7 tp -80.85 -37.38 30.06 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 114.356 -2.735 . . . . 0.0 116.285 171.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.372 1.4 t -59.65 -40.71 88.56 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 121.709 2.05 . . . . 0.0 112.497 -178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -42.48 -63.33 0.78 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 131.189 3.796 . . . . 0.0 108.784 167.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.66 -39.86 81.81 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 127.68 3.113 . . . . 0.0 116.675 -174.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.306 75.2 t -63.81 -60.13 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 129.238 3.015 . . . . 0.0 109.878 174.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -63.52 -31.85 73.14 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.816 2.046 . . . . 0.0 113.22 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 47.8 t -72.24 152.2 42.35 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.413 1.485 . . . . 0.0 111.266 174.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.299 2.2 t60 -148.23 164.14 34.89 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.435 1.894 . . . . 0.0 112.656 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.486 2.714 . . . . 0.0 108.195 173.492 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 ttm . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 132.33 42.86 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.996 2.518 . . . . 0.0 109.136 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -80.66 133.63 35.75 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.276 3.031 . . . . 0.0 103.307 172.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.5 mt -90.94 130.01 40.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 127.755 2.422 . . . . 0.0 110.611 172.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -97.67 132.86 42.93 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 127.384 2.927 . . . . 0.0 105.058 178.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -87.32 135.42 33.33 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 101.659 -3.459 . . . . 0.0 101.659 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.338 0.5 OUTLIER -139.43 169.23 18.14 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.311 -1.313 . . . . 0.0 108.912 171.082 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.38 6.2 t -147.89 -151.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 129.518 3.127 . . . . 0.0 112.654 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.43 89.23 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 130.967 3.707 . . . . 0.0 116.766 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.17 55.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 130.125 3.37 . . . . 0.0 115.012 178.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.25 -24.49 54.53 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 115.749 -2.072 . . . . 0.0 109.687 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -53.18 -37.47 61.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 123.597 1.665 . . . . 0.0 115.272 170.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.3 mt -68.03 -16.85 64.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 126.741 2.016 . . . . 0.0 111.925 -170.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -77.47 -37.13 52.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 123.351 2.796 . . . . 0.0 110.102 169.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -65.72 -39.7 91.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.949 -1.72 . . . . 0.0 110.307 -176.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.3 ttt -83.91 28.06 0.61 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.019 1.727 . . . . 0.0 114.845 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -39.57 -51.7 2.21 Favored 'General case' 0 C--N 1.327 -0.395 1 C-N-CA 132.966 4.506 . . . . 0.0 113.264 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -97.14 4.77 51.07 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 115.965 -1.969 . . . . 0.0 105.84 -167.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -127.96 34.58 4.59 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 123.761 2.982 . . . . 0.0 113.804 167.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.8 p -131.03 86.14 2.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 123.871 1.796 . . . . 0.0 110.861 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -143.67 -38.22 0.32 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 114.611 -2.614 . . . . 0.0 108.375 -171.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.1 pt -103.57 -14.7 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 124.409 3.277 . . . . 0.0 112.415 173.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -136.91 162.55 32.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.1 -2.25 . . . . 0.0 111.113 159.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.3 p -152.16 -43.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 O-C-N 116.473 -3.892 . . . . 0.0 104.965 173.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -81.22 -28.0 35.05 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 117.815 -3.053 . . . . 0.0 107.965 -172.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -78.74 -1.76 36.14 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.167 2.987 . . . . 0.0 110.028 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.5 mm -90.9 -20.98 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 C-N-CA 127.199 2.2 . . . . 0.0 108.693 178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -68.08 -26.24 65.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.808 2.043 . . . . 0.0 111.598 177.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.83 62.38 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 124.731 2.205 . . . . 0.0 111.637 172.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.1 t -80.48 -26.95 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 O-C-N 120.325 -1.485 . . . . 0.0 107.342 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 79.2 t -82.28 -21.99 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 120.255 -1.528 . . . . 0.0 111.946 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.6 m -79.39 -30.23 42.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 119.396 -2.065 . . . . 0.0 114.512 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -63.43 -36.93 85.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.504 1.922 . . . . 0.0 111.723 -172.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.45 -49.83 33.8 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 117.448 -3.283 . . . . 0.0 115.188 169.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.91 -11.54 60.62 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 117.118 -1.42 . . . . 0.0 109.184 -156.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.6 -21.42 26.82 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 131.287 3.835 . . . . 0.0 112.373 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.12 -37.99 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 CA-C-N 120.744 1.611 . . . . 0.0 107.136 173.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.81 -57.3 13.48 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.593 -1.317 . . . . 0.0 111.041 174.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.87 -11.19 54.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -87.8 -53.65 4.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -64.03 -37.92 89.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 177.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.53 -24.32 64.63 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.823 2.156 . . . . 0.0 116.823 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.26 -9.28 57.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.091 -2.385 . . . . 0.0 109.398 174.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 77.3 p -119.44 18.17 12.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 125.843 1.965 . . . . 0.0 108.247 -177.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.341 0.2 OUTLIER 74.59 23.36 1.89 Allowed 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 126.251 1.821 . . . . 0.0 114.385 162.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -103.63 134.53 11.93 Favored Glycine 0 N--CA 1.442 -0.925 0 O-C-N 118.587 -2.571 . . . . 0.0 114.143 177.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -86.6 126.27 34.39 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 124.916 1.286 . . . . 0.0 110.311 -170.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.24 86.73 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 129.188 2.995 . . . . 0.0 106.723 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.4 mtt180 -75.95 133.4 40.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 173.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.259 8.1 mt -131.33 79.16 1.87 Allowed 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 116.554 -1.688 . . . . 0.0 108.982 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -48.68 122.07 5.23 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.8 2.44 . . . . 0.0 108.774 167.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.685 0.0 OUTLIER 105.71 -22.1 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.681 1 C-N-CA 133.335 4.654 . . . . 0.0 111.459 -169.439 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 92.6 mt -106.72 -48.21 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 122.121 2.237 . . . . 0.0 105.869 171.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.28 -90.26 0.24 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-O 127.141 3.634 . . . . 0.0 109.627 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -175.33 166.98 3.38 Favored 'General case' 0 N--CA 1.448 -0.536 1 O-C-N 116.014 -4.227 . . . . 0.0 114.176 169.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 -91.2 143.08 27.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.667 159.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -115.67 127.61 55.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 127.161 2.185 . . . . 0.0 106.169 -168.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.45 135.33 34.3 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.375 169.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.03 146.42 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 C-N-CA 125.541 1.537 . . . . 0.0 107.67 176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.3 150.05 35.02 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 10.0 p -107.54 141.39 39.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 129.219 3.007 . . . . 0.0 108.854 156.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 pttt -74.91 166.05 48.68 Favored Pre-proline 0 N--CA 1.453 -0.311 0 O-C-N 126.544 2.403 . . . . 0.0 109.874 -161.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.268 19.5 Cg_endo -80.74 165.64 19.95 Favored 'Trans proline' 0 N--CA 1.45 -1.059 0 N-CA-C 106.086 -2.313 . . . . 0.0 106.086 174.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.293 69.7 mtm180 -145.45 158.13 43.89 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 129.174 2.99 . . . . 0.0 113.446 -173.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.495 4.4 t -134.83 149.32 50.34 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 118.356 -2.715 . . . . 0.0 111.558 160.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -137.88 -163.0 9.47 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 116.43 -2.317 . . . . 0.0 114.383 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 3.0 mt -115.52 133.14 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 123.557 1.646 . . . . 0.0 108.883 -176.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -66.0 124.93 89.05 Favored Pre-proline 0 N--CA 1.451 -0.398 0 O-C-N 119.184 -2.197 . . . . 0.0 112.772 158.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.56 -33.41 46.02 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.926 3.751 . . . . 0.0 116.857 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -89.09 -31.81 17.84 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 119.613 -1.929 . . . . 0.0 110.88 -165.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 65.1 p -139.89 178.16 7.45 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 128.516 2.726 . . . . 0.0 107.742 -174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -101.35 55.76 0.83 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 124.28 1.99 . . . . 0.0 110.0 -168.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -103.14 142.98 33.22 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 175.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -91.36 131.52 36.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 129.09 2.956 . . . . 0.0 111.848 165.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.0 mt -105.29 117.92 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 100.767 -3.79 . . . . 0.0 100.767 -174.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -88.2 108.72 19.43 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 122.644 1.211 . . . . 0.0 111.417 164.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.0 mt -95.72 130.81 30.71 Favored Pre-proline 0 N--CA 1.445 -0.715 0 N-CA-C 101.851 -3.388 . . . . 0.0 101.851 176.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -87.82 161.86 7.61 Favored 'Trans proline' 0 N--CA 1.446 -1.312 0 C-N-CA 122.853 2.369 . . . . 0.0 108.491 -169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -75.48 164.56 26.24 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.827 1.651 . . . . 0.0 112.393 165.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.59 150.25 17.77 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 -166.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -153.65 140.4 19.03 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.588 168.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -145.39 175.43 10.32 Favored 'General case' 0 N--CA 1.446 -0.65 1 C-N-CA 133.975 4.91 . . . . 0.0 114.671 -174.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 pt -130.53 153.82 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.782 0 C-N-CA 130.448 3.499 . . . . 0.0 114.751 167.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -153.13 156.29 38.36 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 128.092 2.557 . . . . 0.0 109.467 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -88.11 146.36 25.46 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 124.656 2.169 . . . . 0.0 105.347 170.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -129.67 109.22 10.81 Favored 'General case' 0 N--CA 1.45 -0.437 1 O-C-N 112.73 -6.231 . . . . 0.0 106.986 157.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.907 HG23 HG21 ' A' ' 92' ' ' THR . 21.7 m -75.51 153.43 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 127.179 2.192 . . . . 0.0 108.903 174.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.537 ' O ' HG22 ' A' ' 92' ' ' THR . 32.3 t -114.38 160.81 18.71 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.559 2.344 . . . . 0.0 108.937 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.259 17.4 ptpt -50.98 -32.12 20.09 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.073 3.349 . . . . 0.0 116.151 -164.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.8 tt -58.52 -14.69 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 1 C-N-CA 134.625 5.17 . . . . 0.0 114.491 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.35 0.2 OUTLIER -140.02 17.65 2.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 116.66 -3.775 . . . . 0.0 116.647 165.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.907 HG21 HG23 ' A' ' 87' ' ' VAL 0.574 0.7 OUTLIER -152.68 10.65 0.49 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 115.169 -2.348 . . . . 0.0 114.21 -164.154 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.254 3.9 t0 -159.04 101.37 1.6 Allowed 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 120.228 1.376 . . . . 0.0 114.361 170.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 83.63 4.85 0.8 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 130.101 3.36 . . . . 0.0 113.217 -173.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.297 14.4 p -156.47 139.2 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 1 C-N-CA 132.241 4.216 . . . . 0.0 108.331 -171.321 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 65.28 -106.05 0.12 Allowed 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 119.709 3.226 . . . . 0.0 119.709 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 94.5 p -72.12 -14.48 61.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 119.875 3.287 . . . . 0.0 119.875 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.1 t60 -149.98 76.73 1.3 Allowed 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.759 -1.941 . . . . 0.0 105.759 173.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? . . . . . 0 C--O 1.247 0.934 1 C-N-CA 133.386 4.674 . . . . 0.0 107.053 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mtt . . . . . 0 N--CA 1.469 0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.97 138.19 41.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -173.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -112.44 139.24 48.18 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.788 1.235 . . . . 0.0 107.974 163.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 pt -102.63 159.8 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 126.348 1.859 . . . . 0.0 108.718 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -42.73 -46.24 5.05 Favored 'General case' 0 N--CA 1.444 -0.732 1 C-N-CA 136.744 6.018 . . . . 0.0 112.241 -173.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 14.3 p -66.16 -28.78 69.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.282 2.233 . . . . 0.0 114.158 -178.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 26.2 mt -75.86 -37.29 59.09 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -76.16 -35.88 58.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 -175.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.291 . . -78.63 -9.88 59.54 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 131.134 3.773 . . . . 0.0 116.671 176.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.72 -36.96 36.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.355 -1.466 . . . . 0.0 111.163 155.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 tp10 -82.84 -27.85 30.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 116.73 -1.605 . . . . 0.0 114.656 -162.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -54.54 -39.79 68.04 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 122.558 2.436 . . . . 0.0 115.43 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.6 -14.68 58.97 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 173.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -86.49 -45.21 11.33 Favored 'General case' 0 C--N 1.33 -0.249 0 O-C-N 118.813 -2.43 . . . . 0.0 108.13 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -81.99 -38.33 25.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 115.571 -2.157 . . . . 0.0 111.495 -167.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.32 24.1 ttt -136.51 106.85 6.42 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 173.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.283 . . -106.63 -27.62 10.73 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 112.247 -3.739 . . . . 0.0 115.583 163.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 35.2 t70 67.35 35.13 4.46 Favored 'General case' 0 N--CA 1.448 -0.53 1 O-C-N 129.433 4.208 . . . . 0.0 108.67 -169.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.283 52.2 tp10 87.8 -56.44 0.04 OUTLIER 'General case' 0 C--O 1.224 -0.249 1 C-N-CA 133.196 4.599 . . . . 0.0 109.991 -177.902 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.29 9.5 t -159.08 4.4 0.1 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -170.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -70.98 -35.29 72.06 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.229 1.012 . . . . 0.0 112.628 -176.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 61.8 mt -103.87 120.19 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 O-C-N 119.384 -2.073 . . . . 0.0 110.242 177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -108.4 177.02 4.92 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 124.885 1.274 . . . . 0.0 111.323 172.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 63.9 t -53.43 -36.9 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 126.897 2.079 . . . . 0.0 114.948 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -81.93 -13.05 58.05 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.43 1.892 . . . . 0.0 112.931 -172.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -83.23 -50.66 8.2 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 126.408 1.883 . . . . 0.0 109.264 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 23.0 mm -64.12 -41.08 91.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 C-N-CA 130.784 3.634 . . . . 0.0 111.337 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -57.1 -42.01 79.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.721 2.009 . . . . 0.0 113.015 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 47.2 mt -62.24 -63.25 1.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.104 2.561 . . . . 0.0 111.761 173.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.428 2.3 t -43.16 -55.81 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 C-N-CA 129.332 3.053 . . . . 0.0 114.962 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 p -68.54 12.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.725 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.252 7.5 t -140.35 19.09 2.4 Favored 'General case' 0 N--CA 1.442 -0.872 0 C-N-CA 130.131 3.372 . . . . 0.0 112.938 173.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 30.8 t -149.03 -45.66 0.14 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.2 -38.34 83.02 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.107 2.163 . . . . 0.0 115.682 -166.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.9 pm0 -79.17 -13.77 59.51 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 128.339 3.524 . . . . 0.0 109.679 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 28.3 mmtt -87.51 -26.92 22.94 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 115.06 -2.4 . . . . 0.0 114.722 166.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 5.0 t -69.8 -53.49 23.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.283 6.1 mt -75.2 15.22 0.45 Allowed 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 133.99 4.916 . . . . 0.0 117.301 -177.685 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -106.86 -36.41 6.66 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 115.726 -2.083 . . . . 0.0 110.203 158.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -76.46 -32.07 58.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 126.321 2.263 . . . . 0.0 111.295 -164.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -77.39 -5.13 48.6 Favored 'General case' 0 N--CA 1.438 -1.046 0 O-C-N 126.745 2.528 . . . . 0.0 110.413 -170.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.8 mp -105.72 -22.12 13.03 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 118.598 2.814 . . . . 0.0 118.598 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.327 . . -41.6 -27.14 0.09 Allowed 'General case' 0 N--CA 1.45 -0.432 1 N-CA-C 126.714 5.82 . . . . 0.0 126.714 -178.548 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.342 6.6 t -125.43 39.13 4.03 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 127.262 2.225 . . . . 0.0 106.574 170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.361 66.6 p 84.76 129.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.774 1 C-N-CA 137.822 6.449 . . . . 0.0 110.648 171.522 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.25 172.7 25.94 Favored Glycine 0 CA--C 1.522 0.514 0 O-C-N 117.004 -3.56 . . . . 0.0 111.751 171.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -141.69 116.77 9.97 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 121.25 2.525 . . . . 0.0 108.88 167.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.13 97.79 3.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 128.844 2.858 . . . . 0.0 108.772 177.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -83.76 108.16 16.63 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 116.881 -3.637 . . . . 0.0 111.411 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 19.1 mt -129.89 176.44 8.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 111.329 -2.669 . . . . 0.0 105.714 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -122.78 161.15 24.52 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 111.151 -2.749 . . . . 0.0 106.639 -172.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 82.28 -55.43 0.22 Allowed 'General case' 0 N--CA 1.443 -0.779 1 C-N-CA 131.882 4.073 . . . . 0.0 111.481 166.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.34 -39.7 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 116.098 -1.906 . . . . 0.0 108.462 168.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.2 -140.03 12.04 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 125.171 3.623 . . . . 0.0 105.214 -167.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -142.13 166.35 24.95 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 117.441 -3.388 . . . . 0.0 108.472 -171.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.51 143.01 47.8 Favored 'General case' 0 C--O 1.22 -0.498 1 C-N-CA 133.48 4.712 . . . . 0.0 108.32 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -153.95 171.91 18.27 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 128.192 3.432 . . . . 0.0 110.066 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -87.15 151.17 23.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.793 2.437 . . . . 0.0 107.497 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.28 14.0 p -125.43 135.36 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 1 C-N-CA 133.113 4.565 . . . . 0.0 106.929 164.614 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 48.6 p -124.87 144.34 50.37 Favored 'General case' 0 N--CA 1.45 -0.468 1 O-C-N 115.352 -4.593 . . . . 0.0 107.362 -178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 34.6 m -101.01 139.98 35.95 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 127.386 2.929 . . . . 0.0 104.798 173.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.46 ' HA ' ' HD3' ' B' ' 63' ' ' PRO . 0.0 OUTLIER -62.57 145.48 95.01 Favored Pre-proline 0 CA--C 1.517 -0.315 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.157 170.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' B' ' 62' ' ' LYS . 70.8 Cg_endo -81.53 169.05 15.79 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 124.621 3.548 . . . . 0.0 112.915 -157.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -101.26 109.75 21.66 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 125.152 1.381 . . . . 0.0 107.696 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.494 14.0 t -126.45 -175.7 3.46 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.405 -2.18 . . . . 0.0 114.289 -175.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.5 -162.49 22.75 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 128.433 2.92 . . . . 0.0 106.96 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 30.7 mm -85.77 131.5 34.25 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 C-N-CA 128.291 2.636 . . . . 0.0 108.307 176.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -71.17 126.8 91.96 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-O 114.8 -2.524 . . . . 0.0 108.183 169.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -71.21 -34.67 9.7 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 O-C-N 124.565 1.824 . . . . 0.0 113.011 -168.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -86.95 -22.53 25.55 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.877 -3.015 . . . . 0.0 111.202 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.319 2.4 t -152.97 162.85 40.82 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.577 2.751 . . . . 0.0 110.707 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -73.86 78.49 1.62 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 125.14 2.4 . . . . 0.0 113.564 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.335 3.7 pt20 -144.37 178.75 7.71 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.616 -1.928 . . . . 0.0 110.068 172.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -92.27 150.9 20.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 128.294 2.638 . . . . 0.0 115.054 161.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 13.2 mt -69.18 128.1 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 O-C-N 125.701 1.876 . . . . 0.0 109.915 153.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.344 25.7 mt-30 -138.18 65.98 1.45 Allowed 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 56.3 mt -108.53 137.28 19.94 Favored Pre-proline 0 N--CA 1.447 -0.616 0 N-CA-C 104.092 -2.558 . . . . 0.0 104.092 -169.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -66.88 138.5 48.63 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.314 3.343 . . . . 0.0 113.387 175.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.85 -21.41 29.81 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 121.523 1.965 . . . . 0.0 109.976 167.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 113.55 167.95 16.64 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-O 116.292 -2.394 . . . . 0.0 113.427 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -160.07 150.67 18.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 127.981 2.813 . . . . 0.0 107.418 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -147.57 171.78 15.04 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.642 1.577 . . . . 0.0 110.989 -175.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.0 mt -97.25 144.14 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 125.251 2.453 . . . . 0.0 106.023 174.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -127.57 151.44 48.89 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 130.52 3.528 . . . . 0.0 110.802 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 19.1 tp -85.28 151.44 24.05 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 123.937 1.827 . . . . 0.0 108.585 159.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.479 8.8 t -132.5 98.3 4.32 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.097 2.159 . . . . 0.0 112.21 162.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.61 139.41 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 128.052 2.541 . . . . 0.0 113.344 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.5 p -55.09 155.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.756 2.023 . . . . 0.0 114.928 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 71.1 mttt -67.45 -26.39 66.37 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 125.009 1.443 . . . . 0.0 113.708 176.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . 0.616 HD12 ' H ' ' B' ' 90' ' ' ILE . 2.9 mp -78.85 -48.49 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 103.584 -2.747 . . . . 0.0 103.584 -175.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . 0.268 14.2 tp -65.73 -50.5 64.59 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 131.126 3.77 . . . . 0.0 112.159 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . 0.279 2.8 t -70.59 -22.34 62.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.756 -1.84 . . . . 0.0 114.34 -174.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -72.41 -47.48 48.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 124.453 2.073 . . . . 0.0 109.844 171.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.16 -25.06 67.92 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.406 2.682 . . . . 0.0 113.219 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 75.8 t -102.66 -19.28 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.357 2.344 . . . . 0.0 111.191 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.8 -43.44 93.18 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 157.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 37.4 t -64.25 146.89 53.59 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.184 0.902 . . . . 0.0 112.599 168.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -156.66 104.76 2.18 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 112.813 -3.47 . . . . 0.0 107.883 167.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 C--O 1.251 1.136 0 C-N-CA 128.943 2.897 . . . . 0.0 109.736 171.425 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.361 6.0 ttt . . . . . 0 N--CA 1.466 0.329 0 CA-C-O 120.496 0.189 . . . . 0.0 110.719 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.87 155.81 37.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -74.65 111.64 10.05 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.038 1.735 . . . . 0.0 111.511 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.7 mt -69.25 124.41 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.675 0 O-C-N 126.463 2.352 . . . . 0.0 105.608 -173.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -85.86 127.47 34.59 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 120.724 -1.235 . . . . 0.0 111.585 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.5 p -84.28 137.53 33.41 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.626 -1.296 . . . . 0.0 108.902 173.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -149.46 167.81 25.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 120.789 1.632 . . . . 0.0 110.405 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.256 36.5 t -146.54 -149.89 0.31 Allowed 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 129.293 4.12 . . . . 0.0 105.621 167.573 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.24 -31.02 67.05 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 112.944 -1.935 . . . . 0.0 109.904 -172.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.27 -17.35 64.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -73.27 -20.85 60.74 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.335 2.254 . . . . 0.0 109.566 175.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -82.4 -29.5 30.77 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 118.435 -2.666 . . . . 0.0 110.373 -172.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 25.7 mt -45.32 -18.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 131.606 3.963 . . . . 0.0 118.438 175.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -82.25 -22.69 35.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 129.335 3.054 . . . . 0.0 116.594 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -84.76 -17.19 39.04 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 125.446 1.716 . . . . 0.0 112.384 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 8.8 ttt -122.15 24.64 9.39 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.714 2.406 . . . . 0.0 105.73 -172.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -81.1 -8.21 59.72 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 129.466 3.106 . . . . 0.0 117.018 -165.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.52 -14.98 14.91 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.381 13.2 tp10 -99.51 -21.3 15.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 119.845 1.202 . . . . 0.0 110.97 -172.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.0 p -86.51 139.09 31.21 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.211 2.205 . . . . 0.0 113.404 172.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.475 9.7 p-10 -147.52 -52.45 0.2 Allowed 'General case' 0 N--CA 1.439 -1.009 0 C-N-CA 131.381 3.872 . . . . 0.0 115.875 -173.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.6 pt -95.25 -19.54 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.791 2.037 . . . . 0.0 114.873 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.62 141.14 30.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 130.85 3.66 . . . . 0.0 105.572 171.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.5 p -142.12 -38.46 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 116.128 -1.891 . . . . 0.0 107.422 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.05 -21.99 49.8 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 122.443 2.383 . . . . 0.0 112.512 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -58.48 -27.22 64.23 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 120.143 1.338 . . . . 0.0 112.696 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.0 mm -62.63 -26.69 41.27 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 C-N-CA 128.628 2.771 . . . . 0.0 111.46 -170.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.9 mtm180 -49.19 -41.12 35.87 Favored 'General case' 0 C--N 1.346 0.448 0 C-N-CA 131.403 3.881 . . . . 0.0 110.751 169.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB3' HD11 ' B' ' 22' ' ' ILE . 78.5 mt -60.64 -49.55 77.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.242 3.017 . . . . 0.0 113.066 172.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.54 -52.33 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 127.733 2.413 . . . . 0.0 108.93 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.4 t -62.75 -14.36 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 C-N-CA 128.542 2.737 . . . . 0.0 116.632 173.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.2 m -90.9 -32.97 15.8 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.4 3.48 . . . . 0.0 112.499 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.7 p -54.54 -33.02 59.33 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.333 2.716 . . . . 0.0 118.333 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.742 HD12 ' H ' ' A' ' 34' ' ' LEU . 3.2 mp -65.25 -47.18 77.64 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 123.333 1.539 . . . . 0.0 113.705 173.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.79 -29.26 69.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.958 1.703 . . . . 0.0 110.87 -172.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -74.08 -23.09 59.3 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.522 2.729 . . . . 0.0 110.168 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.1 t -93.72 -30.7 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 124.292 3.224 . . . . 0.0 111.727 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' B' ' 53' ' ' ILE . 34.1 mt -68.56 -33.59 74.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 172.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.2 -15.91 59.95 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 124.189 1.947 . . . . 0.0 111.906 172.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -90.03 -49.5 6.55 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.383 -2.073 . . . . 0.0 114.438 170.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -63.53 -43.82 96.04 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 125.917 1.687 . . . . 0.0 111.025 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.2 mt -85.56 -13.83 47.67 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 116.234 -1.841 . . . . 0.0 110.712 -169.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.96 -33.91 16.21 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 121.089 1.768 . . . . 0.0 108.506 176.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.9 p -75.11 -14.54 60.58 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 116.35 1.982 . . . . 0.0 116.35 165.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.256 28.5 m 90.74 53.2 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.244 2.215 . . . . 0.0 112.495 173.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.01 118.94 3.45 Favored Glycine 0 N--CA 1.443 -0.87 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.403 ' HB3' ' HA ' ' B' ' 2' ' ' ALA . 66.4 tt0 -66.78 129.56 40.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.947 2.099 . . . . 0.0 110.009 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.443 HG21 HD23 ' A' ' 38' ' ' LEU . 16.6 t -115.92 111.29 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -92.99 126.93 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 112.949 -1.932 . . . . 0.0 108.299 174.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.5 mt -133.62 75.33 1.6 Allowed 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 131.075 3.75 . . . . 0.0 104.088 -161.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -50.77 103.93 0.07 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 129.585 3.154 . . . . 0.0 116.242 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.5 0.0 OUTLIER 104.51 9.62 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.29 1 C-N-CA 134.055 4.942 . . . . 0.0 116.124 -166.887 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.96 -48.7 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 114.847 -2.502 . . . . 0.0 106.886 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.78 -118.29 3.14 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 114.899 -3.167 . . . . 0.0 111.053 -168.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -157.57 163.29 38.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 122.074 2.937 . . . . 0.0 116.591 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 87.6 m-85 -94.04 102.79 14.87 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 162.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -89.7 131.75 35.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 130.193 3.397 . . . . 0.0 113.712 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 23.0 mt -93.29 111.59 23.28 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 102.06 -3.311 . . . . 0.0 102.06 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 39.2 t -95.78 133.26 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 113.166 -3.302 . . . . 0.0 110.32 173.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.439 7.7 t -145.78 144.74 30.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 121.644 2.02 . . . . 0.0 111.02 -169.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.6 p -113.85 132.46 55.89 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 131.622 3.969 . . . . 0.0 107.847 -173.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -52.5 136.8 42.32 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 129.959 3.303 . . . . 0.0 113.841 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -71.81 157.01 56.15 Favored 'Trans proline' 0 N--CA 1.447 -1.257 0 C-N-CA 122.199 1.933 . . . . 0.0 114.526 166.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.8 mtm105 -142.78 -172.94 3.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 170.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.275 15.0 t -134.7 144.25 47.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.006 2.522 . . . . 0.0 104.963 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.96 -177.43 15.42 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 129.005 3.193 . . . . 0.0 110.969 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.2 mt -135.22 148.38 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 127.847 2.459 . . . . 0.0 106.177 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.09 133.61 78.32 Favored Pre-proline 0 N--CA 1.45 -0.463 0 N-CA-C 103.557 -2.757 . . . . 0.0 103.557 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.08 -9.75 27.2 Favored 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 123.637 2.891 . . . . 0.0 118.393 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tttp -117.79 -53.04 2.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.344 -1.789 . . . . 0.0 113.491 -171.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 61.4 p -100.78 161.29 13.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.467 1.939 . . . . 0.0 109.582 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -78.73 79.4 5.14 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -136.83 152.36 50.18 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 122.953 1.359 . . . . 0.0 113.118 167.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -82.6 157.67 23.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 120.229 -1.544 . . . . 0.0 110.785 172.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.4 mt -123.59 141.25 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 126.84 2.056 . . . . 0.0 106.143 172.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -126.44 125.39 42.06 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 118.597 0.635 . . . . 0.0 112.403 -173.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 12.0 mt -113.27 110.64 50.6 Favored Pre-proline 0 C--O 1.221 -0.435 0 N-CA-C 101.293 -3.595 . . . . 0.0 101.293 -171.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.64 165.4 27.05 Favored 'Trans proline' 0 N--CA 1.441 -1.568 1 C-N-CA 125.925 4.417 . . . . 0.0 112.206 -176.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.02 122.11 24.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 119.793 -1.817 . . . . 0.0 110.366 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -106.63 152.15 16.95 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 120.853 -1.154 . . . . 0.0 112.211 -164.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.316 49.7 pttt -140.73 139.53 34.7 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 121.58 2.69 . . . . 0.0 115.854 174.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -140.98 166.68 24.14 Favored 'General case' 0 N--CA 1.445 -0.711 1 C-N-CA 132.04 4.136 . . . . 0.0 111.513 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.5 pt -134.14 151.69 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 C-N-CA 125.873 1.669 . . . . 0.0 112.586 177.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.0 ptpt -142.85 154.7 44.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 126.762 2.025 . . . . 0.0 110.676 164.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' A' ' 56' ' ' PHE . 10.9 tp -69.87 119.31 13.9 Favored 'General case' 0 N--CA 1.445 -0.699 1 C-N-CA 132.02 4.128 . . . . 0.0 106.987 154.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.8 p -115.48 123.25 48.09 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.61 140.57 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 120.222 3.415 . . . . 0.0 120.222 -165.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 42.2 t -78.43 141.94 37.92 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 126.449 1.9 . . . . 0.0 109.979 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -53.87 -18.5 3.4 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 121.141 3.756 . . . . 0.0 121.141 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.98 -9.94 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 -164.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . 0.456 2.2 pp -135.73 14.94 3.38 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.043 1.737 . . . . 0.0 110.719 -174.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 9.8 t -154.45 -27.63 0.12 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 114.09 -2.862 . . . . 0.0 113.195 -170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -98.08 101.41 12.88 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 121.597 1.999 . . . . 0.0 108.513 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.318 . . 77.85 12.51 1.86 Allowed 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 130.373 3.469 . . . . 0.0 114.874 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.318 5.4 p -157.86 156.68 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 O-C-N 124.915 1.384 . . . . 0.0 107.857 -173.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.592 21.1 m-20 75.46 -87.94 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 128.382 2.673 . . . . 0.0 114.68 167.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.276 77.8 p -82.29 -16.4 49.54 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 128.199 2.6 . . . . 0.0 113.312 175.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.334 75.1 t60 -141.77 49.88 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 111.81 -2.45 . . . . 0.0 115.149 174.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.4 tttt . . . . . 0 C--O 1.255 1.368 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 166.072 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 124.31 2.005 . . . . 0.0 106.352 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 47' ' ' GLU . . . -47.88 138.67 8.52 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 111.082 -2.781 . . . . 0.0 112.489 168.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -109.34 147.85 32.04 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 128.282 2.633 . . . . 0.0 116.826 171.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 18.4 pt -107.62 163.38 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.279 0 C-N-CA 117.393 -1.723 . . . . 0.0 108.355 -177.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -41.74 -56.73 2.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 117.568 -3.207 . . . . 0.0 116.004 -175.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 44.6 p -67.5 -25.29 65.78 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 130.187 3.395 . . . . 0.0 112.431 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' B' ' 7' ' ' LEU . 17.8 tp -82.65 -46.27 13.46 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 127.815 2.446 . . . . 0.0 110.055 177.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -54.45 -39.93 67.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.389 2.676 . . . . 0.0 110.652 167.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.25 -0.21 13.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 115.436 -2.221 . . . . 0.0 110.934 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -96.36 -37.59 10.42 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 126.396 2.31 . . . . 0.0 108.891 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -79.1 -26.5 42.94 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 120.263 1.392 . . . . 0.0 108.771 -168.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -52.53 -37.61 57.97 Favored 'General case' 0 N--CA 1.446 -0.663 1 C-N-CA 133.261 4.625 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.13 6.2 45.93 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.246 -1.797 . . . . 0.0 113.848 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -117.55 -46.6 2.66 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 129.526 3.131 . . . . 0.0 110.249 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 39.6 tp10 -68.86 -26.98 65.41 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.368 -2.707 . . . . 0.0 110.256 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . 0.399 7.7 ttt -137.73 124.48 21.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.71 2.004 . . . . 0.0 114.788 -172.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.16 -37.08 0.19 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.344 25.8 t0 61.18 56.58 2.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.892 2.477 . . . . 0.0 113.366 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 58.4 -75.29 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.563 1 C-N-CA 132.479 4.312 . . . . 0.0 106.804 -153.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -158.93 45.74 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.097 2.159 . . . . 0.0 105.558 -152.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -120.99 -31.61 4.13 Favored 'General case' 0 N--CA 1.441 -0.918 1 O-C-N 115.15 -4.719 . . . . 0.0 111.98 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.415 HD11 ' HB3' ' A' ' 29' ' ' LEU . 49.6 mt -94.58 113.94 30.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 122.555 2.434 . . . . 0.0 112.801 171.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 28.5 mttt -126.76 163.61 23.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 126.625 3.107 . . . . 0.0 110.882 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.17 -33.86 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 O-C-N 116.432 -3.918 . . . . 0.0 113.021 -168.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -66.5 -18.37 65.32 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.318 -1.801 . . . . 0.0 110.285 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.04 -63.63 1.22 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.404 1.882 . . . . 0.0 107.892 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.264 7.0 mm -38.06 -52.96 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 C-N-CA 131.127 3.771 . . . . 0.0 112.057 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.289 30.5 ttm180 -67.55 -2.24 6.3 Favored 'General case' 0 N--CA 1.448 -0.56 1 C-N-CA 132.16 4.184 . . . . 0.0 118.848 -173.857 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 11.1 mt -101.87 -55.3 2.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.021 2.528 . . . . 0.0 113.128 155.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.37 -32.78 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 130.843 3.657 . . . . 0.0 110.532 -170.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.02 0.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 129.366 3.066 . . . . 0.0 111.834 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.436 5.4 t -137.5 17.52 2.92 Favored 'General case' 0 C--O 1.226 -0.176 0 O-C-N 117.72 -3.113 . . . . 0.0 109.419 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.474 1.3 m -138.61 -47.79 0.51 Allowed 'General case' 0 C--O 1.225 -0.222 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -39.7 -49.92 2.29 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.53 1.932 . . . . 0.0 112.542 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.8 pm0 -56.95 -36.87 70.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.838 1.655 . . . . 0.0 113.462 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -74.13 -41.77 61.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.38 2.272 . . . . 0.0 110.299 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 76.3 t -73.99 -38.18 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 116.061 -1.923 . . . . 0.0 110.341 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.419 HD22 HG11 ' B' ' 48' ' ' VAL . 29.0 mt -69.58 27.37 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.392 1 C-N-CA 132.729 4.412 . . . . 0.0 114.359 169.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -148.86 -47.18 0.15 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 129.485 3.114 . . . . 0.0 108.184 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -71.13 -29.02 64.73 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 125.438 1.711 . . . . 0.0 111.633 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -72.61 -17.0 61.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.146 -1.388 . . . . 0.0 112.203 167.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -93.79 -5.53 48.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 119.37 -2.081 . . . . 0.0 114.082 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.286 . . -41.73 -33.19 0.46 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 130.417 3.487 . . . . 0.0 116.407 -174.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.382 9.4 t -136.52 45.59 2.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.807 3.243 . . . . 0.0 111.581 170.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.363 30.2 p 79.76 112.84 0.07 Allowed 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 127.676 2.39 . . . . 0.0 115.934 176.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.96 130.15 7.5 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 129.721 3.534 . . . . 0.0 106.048 -177.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -107.34 113.01 26.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 125.459 2.552 . . . . 0.0 109.332 163.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 HD22 ' B' ' 38' ' ' LEU . 51.9 t -107.0 104.77 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 1 O-C-N 114.71 -4.994 . . . . 0.0 100.285 -166.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -87.65 83.63 7.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.813 1.645 . . . . 0.0 109.719 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.0 mt -100.66 155.16 18.04 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 127.612 2.365 . . . . 0.0 112.025 166.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.27 85.4 m-85 -96.67 168.62 10.41 Favored 'General case' 0 C--O 1.223 -0.315 1 O-C-N 115.955 -4.216 . . . . 0.0 108.842 175.197 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.309 19.7 m-20 88.65 -46.99 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.686 1 C-N-CA 135.573 5.549 . . . . 0.0 112.277 159.052 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.471 HD12 ' HB3' ' A' ' 38' ' ' LEU . 3.2 tt -90.08 -37.28 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 114.281 -2.771 . . . . 0.0 111.136 167.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.4 -161.06 23.9 Favored Glycine 0 C--O 1.222 -0.602 0 CA-C-O 116.369 -2.35 . . . . 0.0 114.034 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -104.75 163.07 12.76 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 125.311 1.242 . . . . 0.0 110.843 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -119.96 147.4 44.81 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 126.246 2.216 . . . . 0.0 106.163 177.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -157.04 164.18 38.23 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.4 2.312 . . . . 0.0 110.327 -174.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.3 tp -87.46 144.84 26.53 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 119.629 -1.92 . . . . 0.0 107.502 169.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 4.4 p -115.43 124.85 72.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 129.414 3.086 . . . . 0.0 109.777 160.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 70.3 p -89.4 147.16 24.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 120.411 -1.431 . . . . 0.0 109.521 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -88.77 141.12 28.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 123.92 1.819 . . . . 0.0 106.108 159.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -51.42 147.42 10.56 Favored Pre-proline 0 N--CA 1.448 -0.533 0 O-C-N 118.361 -2.712 . . . . 0.0 111.16 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -69.72 149.53 67.26 Favored 'Trans proline' 0 N--CA 1.448 -1.168 0 CA-C-O 124.797 1.915 . . . . 0.0 112.334 -178.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtm180 -70.48 121.45 17.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.94 -1.482 . . . . 0.0 108.384 166.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.306 12.9 t -121.99 -137.54 0.31 Allowed 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 116.468 -3.895 . . . . 0.0 112.294 -175.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.38 163.21 20.85 Favored Glycine 0 CA--C 1.527 0.784 1 O-C-N 116.207 -4.058 . . . . 0.0 109.313 -177.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.89 145.02 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 103.538 -2.764 . . . . 0.0 103.538 167.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -80.3 129.56 68.98 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 127.847 3.217 . . . . 0.0 107.42 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -84.63 -26.06 1.77 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 0 CA-C-O 118.04 -0.9 . . . . 0.0 110.332 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -77.4 -29.14 52.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 117.881 2.548 . . . . 0.0 117.881 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.3 t -148.18 160.87 42.48 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.11 2.564 . . . . 0.0 108.469 162.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -78.33 103.04 8.02 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.853 0.751 . . . . 0.0 109.663 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -165.7 173.5 10.7 Favored 'General case' 0 N--CA 1.448 -0.546 1 C-N-CA 131.71 4.004 . . . . 0.0 107.697 -176.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -101.89 129.43 48.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 125.202 1.564 . . . . 0.0 109.73 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 26.6 mt -70.03 148.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 O-C-N 125.656 1.847 . . . . 0.0 113.632 171.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -160.58 73.63 0.5 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 104.397 -2.446 . . . . 0.0 104.397 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 91.2 mt -107.75 129.14 24.6 Favored Pre-proline 0 N--CA 1.446 -0.671 0 C-N-CA 128.02 2.528 . . . . 0.0 106.597 177.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.75 141.93 34.76 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.637 2.891 . . . . 0.0 108.749 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -86.49 -38.57 17.14 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.744 2.418 . . . . 0.0 116.861 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.25 -177.85 19.26 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 125.856 1.693 . . . . 0.0 112.949 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 14.1 pttt -165.51 149.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 -173.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -139.87 162.68 34.59 Favored 'General case' 0 N--CA 1.45 -0.45 1 O-C-N 130.212 4.695 . . . . 0.0 113.823 -174.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.0 mt -89.96 147.24 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 127.57 3.044 . . . . 0.0 109.019 173.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -147.27 157.07 43.46 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 124.503 1.121 . . . . 0.0 108.482 168.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.4 tp -84.16 153.5 23.65 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.951 2.101 . . . . 0.0 106.861 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 8.7 t -114.75 114.02 25.05 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 103.084 -2.932 . . . . 0.0 103.084 157.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . 0.254 13.4 p -63.18 145.64 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 123.903 1.811 . . . . 0.0 113.309 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -77.99 152.84 32.9 Favored 'General case' 0 N--CA 1.443 -0.787 1 O-C-N 115.81 -4.306 . . . . 0.0 113.367 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -67.25 -18.76 65.35 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 129.089 2.955 . . . . 0.0 109.953 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 76.3 mt -78.08 -53.2 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 C-N-CA 129.632 3.173 . . . . 0.0 104.944 174.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' B' ' 53' ' ' ILE . 41.2 tp -72.06 -41.47 67.39 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.187 2.195 . . . . 0.0 106.773 -166.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 7.7 t -62.8 -39.99 95.98 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 118.519 0.599 . . . . 0.0 111.276 -176.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . 0.276 29.1 t70 -66.59 -27.62 67.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 125.607 1.817 . . . . 0.0 111.812 177.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.55 -29.24 13.56 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 120.648 1.567 . . . . 0.0 109.323 -175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -56.23 -50.12 72.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 122.854 2.57 . . . . 0.0 113.216 154.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -51.37 -43.25 61.81 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 125.038 2.351 . . . . 0.0 117.164 170.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 38.3 m -77.18 155.42 32.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.054 -2.279 . . . . 0.0 106.929 176.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . 0.316 58.7 t60 -143.95 154.39 43.26 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 127.561 2.344 . . . . 0.0 113.379 -178.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.294 18.5 ptmt . . . . . 0 C--O 1.253 1.249 0 CA-C-N 114.29 -1.323 . . . . 0.0 107.852 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.3 ttm . . . . . 0 N--CA 1.467 0.392 1 N-CA-C 100.165 -4.013 . . . . 0.0 100.165 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.09 109.07 18.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -139.52 141.11 37.32 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.119 2.168 . . . . 0.0 111.113 -177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.5 mt -92.23 105.45 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 C-N-CA 129.413 3.085 . . . . 0.0 109.035 171.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -62.21 132.19 51.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 118.068 -2.895 . . . . 0.0 111.996 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.4 p -92.74 125.28 37.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 120.209 1.368 . . . . 0.0 110.339 165.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.87 172.83 12.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 115.199 -2.334 . . . . 0.0 113.294 163.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.5 t -144.92 -145.61 0.17 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 133.538 4.735 . . . . 0.0 108.23 169.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.308 . . -81.57 -9.36 59.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -168.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.59 -10.87 55.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.202 1.801 . . . . 0.0 115.009 -174.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.6 6.18 49.61 Favored 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 125.572 1.795 . . . . 0.0 110.828 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -84.4 -31.54 24.63 Favored 'General case' 0 N--CA 1.456 -0.155 1 O-C-N 115.293 -4.629 . . . . 0.0 112.439 171.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.03 -47.52 80.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.153 3.381 . . . . 0.0 113.043 -171.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -19.14 7.43 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 171.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -93.81 -0.3 55.9 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 125.594 2.616 . . . . 0.0 111.819 175.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -112.82 14.68 19.91 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.148 3.379 . . . . 0.0 115.486 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.7 -48.14 72.83 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 130.421 3.488 . . . . 0.0 115.895 -159.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -23.99 21.36 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 126.652 2.47 . . . . 0.0 114.261 168.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -65.01 -13.1 57.01 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 128.208 2.603 . . . . 0.0 117.709 170.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 26.8 p -102.49 125.83 49.34 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 101.605 -3.48 . . . . 0.0 101.605 170.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.295 18.4 p30 -155.33 -20.25 0.11 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 112.24 -3.743 . . . . 0.0 111.17 -173.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.1 pt -130.75 -23.92 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-O 113.737 -3.03 . . . . 0.0 106.796 170.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.3 pttt -129.19 157.47 41.73 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 131.109 3.764 . . . . 0.0 110.444 164.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.349 12.9 p -146.92 -49.08 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -174.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 6.6 mt-30 -98.92 -8.44 25.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 117.389 -3.319 . . . . 0.0 112.314 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -75.28 -0.63 20.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.15 -2.844 . . . . 0.0 109.283 168.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.4 mm -80.83 -30.49 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 130.249 3.42 . . . . 0.0 110.311 168.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 25' ' ' GLN . 50.9 mtm180 -52.47 -36.82 55.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 O-C-N 117.602 -3.186 . . . . 0.0 116.823 171.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.65 -23.85 65.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.084 2.954 . . . . 0.0 113.25 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -74.54 -49.48 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 1 O-C-N 129.683 4.364 . . . . 0.0 111.409 171.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG13 HD21 ' B' ' 34' ' ' LEU . 46.1 t -62.14 -30.72 49.42 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.324 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 m -70.74 -18.39 62.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 117.561 -3.212 . . . . 0.0 116.261 171.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.0 p -84.36 -41.42 16.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.203 -2.811 . . . . 0.0 110.587 -168.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.5 mp -47.01 -50.97 18.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -68.8 -23.59 64.3 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 128.965 3.915 . . . . 0.0 110.841 -165.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -84.93 -25.96 27.54 Favored 'General case' 0 CA--C 1.519 -0.24 2 O-C-N 112.718 -6.239 . . . . 0.0 108.604 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -82.47 -47.77 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 124.378 2.037 . . . . 0.0 106.819 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.417 HD21 HG11 ' A' ' 48' ' ' VAL . 26.3 mt -69.18 -24.4 64.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 120.462 -1.399 . . . . 0.0 109.373 -171.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.75 -10.13 59.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.383 1.473 . . . . 0.0 112.744 -176.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.5 mttt -90.35 -40.83 11.86 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 125.683 1.593 . . . . 0.0 108.523 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -74.97 -36.58 62.05 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 127.442 2.297 . . . . 0.0 109.461 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.46 HD21 ' HB3' ' A' ' 56' ' ' PHE . 70.3 mt -73.39 -17.92 61.22 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 172.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -87.54 -25.63 23.56 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 115.916 -1.992 . . . . 0.0 110.376 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.255 32.7 p -110.51 -0.8 17.25 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.186 -1.864 . . . . 0.0 114.287 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.46 3.5 m 87.84 50.08 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.964 0 O-C-N 125.798 1.936 . . . . 0.0 106.202 162.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.12 154.96 19.64 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 105.846 -2.902 . . . . 0.0 105.846 158.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -84.19 160.74 20.77 Favored 'General case' 0 N--CA 1.451 -0.38 1 C-N-CA 131.884 4.074 . . . . 0.0 108.934 -176.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.417 HG11 HD21 ' A' ' 38' ' ' LEU . 19.4 t -142.61 126.54 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 101.49 -3.522 . . . . 0.0 101.49 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 mtt180 -101.89 116.57 32.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.348 3.459 . . . . 0.0 111.844 178.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.0 mt -115.06 97.93 6.5 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 104.47 -2.418 . . . . 0.0 104.47 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -56.82 112.01 1.19 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 128.714 2.806 . . . . 0.0 111.093 175.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.678 0.0 OUTLIER 99.18 0.07 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.978 1.711 . . . . 0.0 115.606 -167.184 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 53' ' ' ILE . 91.3 mt -113.09 -49.4 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 122.129 2.24 . . . . 0.0 106.499 152.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 130.05 -129.23 5.87 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 -158.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -156.12 145.94 21.15 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.245 2.523 . . . . 0.0 115.542 -174.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.46 ' HB3' HD21 ' A' ' 42' ' ' LEU . 55.4 m-85 -90.8 102.94 15.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 170.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -101.62 137.1 40.39 Favored 'General case' 0 C--O 1.238 0.468 2 C-N-CA 134.31 5.044 . . . . 0.0 105.925 -158.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 mt -83.59 127.47 33.77 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 114.049 -2.882 . . . . 0.0 112.143 169.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.317 31.6 m -129.87 165.28 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 122.609 2.458 . . . . 0.0 112.067 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.501 4.9 t -135.93 152.66 51.22 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 118.287 -2.758 . . . . 0.0 114.11 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.6 p -116.96 112.16 20.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 113.892 -2.956 . . . . 0.0 108.737 173.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.298 31.6 pttt -35.21 135.18 0.45 Allowed Pre-proline 0 N--CA 1.446 -0.673 0 C-N-CA 130.075 3.35 . . . . 0.0 118.118 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.21 178.43 4.85 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 CA-C-O 124.636 1.848 . . . . 0.0 110.165 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -130.37 -179.05 5.03 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.033 2.133 . . . . 0.0 111.945 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.8 t -155.87 146.14 21.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 129.98 3.312 . . . . 0.0 112.44 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.79 -162.48 9.83 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 117.829 -2.129 . . . . 0.0 111.817 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.8 pt -140.22 148.82 22.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 131.485 3.914 . . . . 0.0 109.53 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -79.44 153.43 76.37 Favored Pre-proline 0 N--CA 1.446 -0.658 0 C-N-CA 131.062 3.745 . . . . 0.0 105.988 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -89.03 -15.52 2.48 Favored 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 125.236 3.958 . . . . 0.0 115.96 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -89.33 -52.63 4.94 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.311 -3.368 . . . . 0.0 111.283 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.7 p -126.37 152.71 45.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 127.756 3.16 . . . . 0.0 107.16 -165.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -70.27 37.22 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 123.88 1.8 . . . . 0.0 114.504 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -88.83 141.43 28.51 Favored 'General case' 0 N--CA 1.445 -0.721 1 O-C-N 114.639 -5.038 . . . . 0.0 104.197 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -100.73 128.35 46.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 129.284 3.034 . . . . 0.0 103.887 175.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 19.1 mt -92.25 128.4 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 116.79 -1.576 . . . . 0.0 107.744 173.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -103.33 142.01 34.95 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.9 mt -133.55 121.84 16.49 Favored Pre-proline 0 N--CA 1.45 -0.462 0 CA-C-O 112.559 -3.591 . . . . 0.0 109.591 -161.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -92.63 174.58 1.93 Allowed 'Trans proline' 0 N--CA 1.445 -1.349 0 O-C-N 125.518 2.325 . . . . 0.0 110.997 -159.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.21 167.7 16.42 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 109.957 -3.292 . . . . 0.0 110.445 -171.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.13 127.52 6.5 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 122.206 2.276 . . . . 0.0 107.708 166.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -93.45 151.07 19.97 Favored 'General case' 0 CA--C 1.515 -0.384 0 O-C-N 124.909 1.005 . . . . 0.0 110.164 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -137.77 166.99 22.64 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.523 1.129 . . . . 0.0 109.68 -168.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 5.2 pt -131.19 146.54 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 127.92 3.262 . . . . 0.0 107.777 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -148.57 154.19 39.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 123.826 1.774 . . . . 0.0 110.75 163.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.57 139.1 31.71 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 129.36 3.064 . . . . 0.0 106.306 167.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -125.79 126.49 44.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 128.586 2.754 . . . . 0.0 104.845 177.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.3 m -102.73 125.2 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.874 173.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 51.3 m -61.83 159.48 13.75 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 127.392 2.932 . . . . 0.0 109.704 164.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.3 pttt -54.11 -38.55 65.52 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 111.491 -2.595 . . . . 0.0 114.929 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 tp -57.4 -14.44 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 119.355 3.094 . . . . 0.0 119.355 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -137.15 38.8 2.53 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.383 2.735 . . . . 0.0 118.383 158.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.444 13.8 t -145.51 -40.29 0.23 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 124.55 2.119 . . . . 0.0 115.581 163.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -86.99 84.8 7.26 Favored 'General case' 0 N--CA 1.451 -0.385 1 O-C-N 114.082 -5.386 . . . . 0.0 105.736 -160.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 71.33 27.43 3.15 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 171.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.334 9.6 p -146.89 142.35 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 C-N-CA 127.527 2.331 . . . . 0.0 105.726 172.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 62.98 -94.28 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 129.162 2.985 . . . . 0.0 114.344 171.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.426 ' CB ' HD11 ' B' ' 83' ' ' ILE . 88.9 p -86.67 -17.43 33.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.724 1.249 . . . . 0.0 109.073 -157.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.251 10.6 t60 -133.05 47.13 2.53 Favored 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 132.57 4.348 . . . . 0.0 109.248 173.639 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.99 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttp . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 120.734 0.302 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.86 148.51 25.23 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.178 2.591 . . . . 0.0 111.482 175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -131.33 167.01 19.98 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.183 1.393 . . . . 0.0 110.822 166.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . 0.288 19.0 pt -121.55 160.27 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 126.183 1.793 . . . . 0.0 114.57 -171.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -43.37 -51.39 6.46 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.903 2.881 . . . . 0.0 118.634 170.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 90.1 p -58.39 -35.87 72.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 169.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -81.22 -42.42 20.79 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 121.648 2.022 . . . . 0.0 108.683 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -64.1 -28.77 70.0 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.86 -23.24 63.24 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.097 1.759 . . . . 0.0 112.539 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.88 -8.77 56.98 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 171.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -91.87 -22.62 19.99 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 125.824 1.65 . . . . 0.0 112.46 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -72.03 -32.36 67.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 113.085 -1.87 . . . . 0.0 111.603 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.89 -23.11 61.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 125.842 1.657 . . . . 0.0 114.054 168.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -83.71 -50.41 8.19 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.025 2.53 . . . . 0.0 106.286 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -61.88 -42.77 99.47 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.325 -1.485 . . . . 0.0 110.677 170.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 8.4 ttt -156.52 108.11 2.46 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.21 -25.91 6.03 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 120.524 -1.36 . . . . 0.0 111.95 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' B' ' 21' ' ' ASN 0.284 25.6 t70 78.24 44.58 0.07 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.235 1.814 . . . . 0.0 109.254 -171.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.277 48.3 tp10 79.98 -74.85 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.505 1.522 . . . . 0.0 109.668 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.6 t -152.42 22.72 0.63 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 128.93 2.892 . . . . 0.0 113.678 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.47 ' HB3' ' HB3' ' B' ' 18' ' ' ASP . 57.6 t-20 -87.45 -38.04 16.46 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.957 -1.714 . . . . 0.0 110.587 -166.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 10.7 mt -92.2 138.52 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 168.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -123.31 171.12 9.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.484 1.513 . . . . 0.0 107.766 174.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . 0.295 11.2 p -61.62 -34.93 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 127.517 2.327 . . . . 0.0 108.924 -171.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -59.98 -21.18 60.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 114.074 -2.869 . . . . 0.0 115.847 170.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -94.67 -30.51 14.27 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.329 2.268 . . . . 0.0 110.53 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.1 mm -64.68 -46.54 92.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 C-N-CA 124.125 0.97 . . . . 0.0 110.59 165.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -58.23 -30.5 66.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.965 3.306 . . . . 0.0 112.988 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . 0.266 0.2 OUTLIER -74.66 -67.38 0.64 Allowed 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 168.472 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 t -54.84 -33.84 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 C-N-CA 130.14 3.376 . . . . 0.0 113.414 -169.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -78.89 11.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 122.155 2.252 . . . . 0.0 111.659 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.282 5.4 t -142.56 28.41 1.63 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.405 1.882 . . . . 0.0 109.927 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -149.77 -41.09 0.14 Allowed 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.625 1.97 . . . . 0.0 113.734 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 31' ' ' VAL . 18.4 tp -58.07 -43.26 86.89 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 118.763 -2.461 . . . . 0.0 115.365 -177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pm0 -64.27 -11.49 32.14 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.59 3.056 . . . . 0.0 111.874 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -91.34 -50.01 6.04 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 125.794 3.906 . . . . 0.0 109.347 174.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.432 ' C ' ' H ' ' B' ' 39' ' ' ALA . 3.4 t -52.99 -60.9 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 125.134 1.374 . . . . 0.0 110.18 172.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.4 mt -75.21 47.42 0.37 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 116.485 2.031 . . . . 0.0 116.485 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' B' ' 37' ' ' VAL . . . -152.55 -55.59 0.13 Allowed 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 110.484 -3.053 . . . . 0.0 109.123 171.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -64.01 -29.05 70.23 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.549 2.426 . . . . 0.0 117.549 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -88.46 2.75 52.15 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 117.488 -1.244 . . . . 0.0 108.35 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.495 HD13 HG12 ' B' ' 83' ' ' ILE . 72.5 mt -91.9 -15.88 27.45 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 116.255 -1.831 . . . . 0.0 114.68 162.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -25.3 58.89 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 123.536 2.88 . . . . 0.0 110.355 -162.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -60.22 -7.97 2.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 131.323 3.849 . . . . 0.0 116.341 166.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.467 7.2 p 74.58 109.89 0.07 Allowed 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 126.468 1.907 . . . . 0.0 106.792 -149.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -139.68 165.69 25.79 Favored Glycine 0 CA--C 1.524 0.637 0 O-C-N 118.287 -2.758 . . . . 0.0 113.074 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -123.66 110.68 15.29 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 129.315 3.046 . . . . 0.0 104.186 167.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.425 HG23 HD21 ' B' ' 42' ' ' LEU . 8.8 t -88.2 108.1 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 C-N-CA 129.315 3.046 . . . . 0.0 108.618 166.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -89.57 101.85 14.54 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 128.119 3.387 . . . . 0.0 103.824 -171.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.9 mt -94.32 172.06 8.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.238 1.018 . . . . 0.0 109.904 172.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -109.5 163.43 13.45 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 124.39 2.043 . . . . 0.0 107.683 169.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.331 8.0 m-20 78.84 -72.39 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 129.163 2.985 . . . . 0.0 112.896 171.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -61.31 -37.25 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.413 ' HA2' ' HB3' ' B' ' 88' ' ' SER . . . 135.72 -149.2 19.94 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-O 116.665 -2.186 . . . . 0.0 112.621 -151.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 42.5 pttt -143.21 156.0 44.65 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 128.724 2.81 . . . . 0.0 109.598 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -110.0 140.85 43.58 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 104.389 -2.448 . . . . 0.0 104.389 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.369 36.7 pttt -147.13 162.81 38.1 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 112.611 -2.086 . . . . 0.0 115.307 171.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -79.02 163.67 24.99 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 p -129.89 141.56 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 125.932 2.02 . . . . 0.0 109.467 157.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 46.8 p -94.95 129.25 42.06 Favored 'General case' 0 N--CA 1.443 -0.785 1 C-N-CA 132.721 4.409 . . . . 0.0 103.041 172.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 52.9 m -69.12 152.44 45.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 129.758 3.223 . . . . 0.0 109.094 154.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.42 139.01 83.9 Favored Pre-proline 0 N--CA 1.44 -0.935 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -73.71 157.33 48.3 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.823 2.349 . . . . 0.0 115.181 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.367 23.6 mtm105 -92.48 165.67 12.92 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.078 -4.139 . . . . 0.0 108.267 -178.279 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.371 11.7 t -141.68 -161.31 1.2 Allowed 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 124.99 1.432 . . . . 0.0 114.656 -177.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.41 -147.55 19.23 Favored Glycine 0 N--CA 1.441 -0.98 0 C-N-CA 129.304 3.335 . . . . 0.0 109.754 173.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . 0.259 18.8 mm -120.36 134.1 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 C-N-CA 128.385 2.674 . . . . 0.0 109.674 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -66.06 128.76 94.03 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.904 2.482 . . . . 0.0 107.841 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.96 -21.53 14.03 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-O 113.387 -2.839 . . . . 0.0 118.737 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.371 86.4 mttt -94.59 -17.09 22.66 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.939 2.649 . . . . 0.0 113.828 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.377 1.4 t -152.18 163.51 39.24 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.798 1.639 . . . . 0.0 109.739 177.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -80.03 92.57 5.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 125.15 2.405 . . . . 0.0 107.765 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.298 12.8 pt20 -155.59 161.09 40.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 108.908 -3.769 . . . . 0.0 108.995 165.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -83.95 166.42 17.84 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.78 1.925 . . . . 0.0 109.199 172.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 76.1 mt -103.82 143.29 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 124.553 2.12 . . . . 0.0 105.617 175.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -144.23 102.7 3.9 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 108.477 -3.965 . . . . 0.0 103.279 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 12.3 pt -140.07 146.35 46.04 Favored Pre-proline 0 N--CA 1.452 -0.337 0 CA-C-N 120.927 1.694 . . . . 0.0 108.856 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -72.2 154.2 56.8 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 125.243 3.962 . . . . 0.0 113.609 -175.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -113.77 -20.68 11.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.911 2.084 . . . . 0.0 110.051 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.02 -171.05 14.59 Favored Glycine 0 C--N 1.333 0.385 0 N-CA-C 118.352 2.101 . . . . 0.0 118.352 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 11.6 pttt -152.09 162.42 41.14 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.141 1.776 . . . . 0.0 111.711 -162.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -154.44 -171.91 4.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 127.368 2.267 . . . . 0.0 108.838 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.495 HG12 HD13 ' B' ' 42' ' ' LEU . 11.0 mt -108.85 159.07 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 CA-C-O 125.148 2.404 . . . . 0.0 111.493 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt -148.35 155.82 41.75 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 118.836 -2.415 . . . . 0.0 107.235 -176.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.25 55.2 tp -89.02 153.46 20.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 102.407 -3.183 . . . . 0.0 102.407 162.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.72 124.93 36.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 111.627 -2.533 . . . . 0.0 106.19 158.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -82.7 147.18 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 120.666 -1.271 . . . . 0.0 112.641 -167.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.413 ' HB3' ' HA2' ' B' ' 54' ' ' GLY . 97.5 p -72.04 159.29 34.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 118.194 -2.816 . . . . 0.0 110.057 -175.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . 0.481 ' HA ' HG22 ' B' ' 92' ' ' THR . 77.6 mttt -66.07 -22.6 66.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.121 2.569 . . . . 0.0 112.56 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 66.0 mt -70.95 -51.58 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 126.334 1.854 . . . . 0.0 109.491 173.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 29.5 tp -84.4 -34.83 23.46 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 121.064 -1.022 . . . . 0.0 108.986 -169.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . 0.481 HG22 ' HA ' ' B' ' 89' ' ' LYS . 6.2 t -66.37 -13.76 61.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 119.043 -2.286 . . . . 0.0 115.505 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -72.74 -25.4 61.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 131.07 3.748 . . . . 0.0 106.166 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . 0.253 . . -93.52 -28.76 15.89 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.181 -2.199 . . . . 0.0 112.732 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 43.5 t -83.41 -45.78 18.63 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 1 C-N-CA 132.122 4.169 . . . . 0.0 107.138 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -83.61 45.67 1.08 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 128.015 2.526 . . . . 0.0 111.346 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 28.9 t -160.32 117.21 2.45 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 130.031 3.333 . . . . 0.0 107.523 -167.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -84.71 116.1 23.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.575 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.31 16.1 pttm . . . . . 0 C--O 1.246 0.869 0 O-C-N 125.885 1.99 . . . . 0.0 113.73 161.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ttt . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 116.409 -1.758 . . . . 0.0 106.481 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.251 . . -88.3 -177.58 5.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 128.341 2.656 . . . . 0.0 109.823 -176.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -89.4 153.35 20.92 Favored 'General case' 0 N--CA 1.446 -0.662 0 O-C-N 127.002 2.689 . . . . 0.0 110.025 169.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 4' ' ' ILE . 23.8 mt -117.06 119.14 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 100.86 -3.756 . . . . 0.0 100.86 159.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -69.35 112.47 5.92 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -80.85 127.11 32.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.354 -3.341 . . . . 0.0 107.38 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.79 164.7 27.31 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 127.1 2.75 . . . . 0.0 109.202 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 t -151.36 -148.34 0.26 Allowed 'General case' 0 C--N 1.327 -0.399 0 O-C-N 127.565 3.04 . . . . 0.0 104.145 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.82 -39.13 70.93 Favored 'General case' 0 N--CA 1.45 -0.475 1 CA-C-O 111.017 -4.325 . . . . 0.0 115.88 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -47.28 -36.65 9.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.428 2.691 . . . . 0.0 116.662 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -67.67 -10.52 52.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -89.54 -28.44 19.6 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mt -75.46 -25.02 57.06 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 119.978 -1.701 . . . . 0.0 110.739 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.22 -32.64 59.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 117.688 -3.132 . . . . 0.0 108.778 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.254 8.0 tp10 -93.36 -12.71 29.3 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 120.518 -1.364 . . . . 0.0 111.385 -173.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.303 6.3 ttt -96.41 12.05 32.67 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 128.162 2.585 . . . . 0.0 115.7 173.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -30.95 43.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 117.37 2.359 . . . . 0.0 117.37 -172.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -85.27 -8.14 58.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 125.055 2.359 . . . . 0.0 113.322 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -129.28 23.53 5.57 Favored 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 116.995 -3.566 . . . . 0.0 110.053 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.7 p -132.0 114.79 15.02 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.967 2.907 . . . . 0.0 107.288 159.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -150.26 -15.91 0.25 Allowed 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 -170.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -121.73 -3.94 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-N 121.941 2.155 . . . . 0.0 112.541 158.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.258 34.8 pttt -142.36 163.65 32.27 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 130.403 3.481 . . . . 0.0 108.786 172.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.1 p -146.26 -49.92 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 120.531 1.514 . . . . 0.0 110.844 164.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.313 93.4 mm-40 -87.71 -13.01 43.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 118.443 -2.661 . . . . 0.0 113.439 -172.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -68.48 -19.08 64.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 117.899 -3.001 . . . . 0.0 112.818 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.0 mm -59.17 -31.79 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 1 C-N-CA 131.958 4.103 . . . . 0.0 111.118 170.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 mtm180 -67.9 -26.2 65.88 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.891 2.132 . . . . 0.0 112.642 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.4 mt -69.91 -34.0 72.92 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 129.012 2.925 . . . . 0.0 111.518 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.7 t -66.58 -41.97 89.2 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.315 0 C-N-CA 127.256 2.222 . . . . 0.0 111.322 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.33 -25.57 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 C-N-CA 127.695 2.398 . . . . 0.0 111.348 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 79.6 m -68.68 -41.46 79.22 Favored 'General case' 0 N--CA 1.451 -0.386 1 C-N-CA 132.82 4.448 . . . . 0.0 111.775 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 p -64.95 -25.85 68.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.383 1.073 . . . . 0.0 112.799 -173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.446 HD11 ' CG1' ' B' ' 30' ' ' VAL . 84.9 mt -67.33 -41.76 84.72 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.224 1.409 . . . . 0.0 112.236 175.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . 0.318 47.8 mm-40 -85.16 -24.11 28.08 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 120.105 -1.622 . . . . 0.0 110.806 -169.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -62.24 -21.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 177.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.5 t -89.42 -47.69 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 O-C-N 124.288 0.993 . . . . 0.0 109.502 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.0 mt -44.2 -45.61 8.49 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.047 3.339 . . . . 0.0 111.263 166.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.29 -28.31 7.59 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 129.254 3.022 . . . . 0.0 116.971 170.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -98.25 -66.55 0.89 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 114.561 -2.637 . . . . 0.0 108.205 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -54.58 -42.43 71.06 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 130.266 3.426 . . . . 0.0 110.019 -166.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.9 mt -88.89 7.8 32.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 127.128 2.171 . . . . 0.0 112.906 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . 0.314 . . -107.38 -43.12 4.63 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.852 -3.03 . . . . 0.0 106.886 168.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -72.0 -12.07 61.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 115.406 -2.235 . . . . 0.0 108.726 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.376 11.8 m 95.25 62.47 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.844 3.658 . . . . 0.0 114.65 171.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -120.4 159.02 15.35 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 129.697 3.522 . . . . 0.0 108.85 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.35 150.15 20.56 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.813 1.645 . . . . 0.0 110.157 165.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.276 69.4 t -135.48 119.88 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 101.797 -3.409 . . . . 0.0 101.797 173.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.256 77.7 mtt180 -101.56 114.05 27.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 102.206 -3.257 . . . . 0.0 102.206 -178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.6 mt -116.26 96.93 5.78 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.722 2.409 . . . . 0.0 109.398 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.92 113.28 2.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 113.088 -3.339 . . . . 0.0 109.422 -178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.541 0.0 OUTLIER 103.79 0.49 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 129.131 2.972 . . . . 0.0 112.164 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.278 78.8 mt -117.36 -57.8 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 129.283 3.033 . . . . 0.0 107.335 168.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.24 -124.13 3.45 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 125.786 1.66 . . . . 0.0 109.811 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -135.94 163.09 31.07 Favored 'General case' 0 C--O 1.225 -0.214 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -87.55 123.22 32.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 111.098 -2.774 . . . . 0.0 106.067 154.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -111.68 126.3 54.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 111.076 -2.784 . . . . 0.0 108.148 -174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.12 123.35 32.07 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.262 31.3 m -117.1 145.37 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.258 6.1 t -143.3 118.65 10.25 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 113.974 -1.467 . . . . 0.0 112.467 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 20.6 p -76.91 157.05 31.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.168 1.914 . . . . 0.0 116.168 170.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -55.72 146.91 43.93 Favored Pre-proline 0 N--CA 1.448 -0.527 1 C-N-CA 132.536 4.334 . . . . 0.0 115.439 -174.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -81.57 152.8 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 167.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.284 35.1 mtm105 -121.37 161.27 22.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 129.5 3.12 . . . . 0.0 110.801 -175.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.34 13.3 t -144.02 101.52 3.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.871 2.869 . . . . 0.0 108.895 166.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.4 -173.05 14.5 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 126.347 1.927 . . . . 0.0 110.138 173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.1 pt -106.95 160.39 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 O-C-N 116.701 -3.823 . . . . 0.0 103.688 -160.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -72.25 144.2 86.77 Favored Pre-proline 0 N--CA 1.444 -0.734 0 O-C-N 118.421 -2.674 . . . . 0.0 111.669 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -75.3 -12.54 20.94 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.697 2.931 . . . . 0.0 118.585 -169.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -151.67 -8.25 0.22 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 115.39 -2.243 . . . . 0.0 113.171 -171.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.353 53.5 p -134.14 152.13 51.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 128.04 2.536 . . . . 0.0 106.461 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -74.2 61.15 0.84 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.317 2.247 . . . . 0.0 115.368 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -133.0 163.8 28.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 128.278 2.631 . . . . 0.0 116.67 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.6 141.51 50.25 Favored 'General case' 0 N--CA 1.45 -0.435 1 C-N-CA 132.778 4.431 . . . . 0.0 106.358 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.9 mt -116.12 157.22 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.326 52.1 mm-40 -109.31 105.93 15.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 124.435 2.064 . . . . 0.0 106.133 159.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.3 mt -90.26 129.5 45.35 Favored Pre-proline 0 N--CA 1.452 -0.342 0 O-C-N 117.285 -3.384 . . . . 0.0 106.188 -173.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.11 165.67 32.09 Favored 'Trans proline' 0 N--CA 1.445 -1.351 0 C-N-CA 122.243 1.962 . . . . 0.0 114.673 -170.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.02 147.51 42.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.42 163.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -124.11 178.99 16.29 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 127.254 3.697 . . . . 0.0 113.301 170.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -145.08 143.77 30.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 112.052 -2.074 . . . . 0.0 113.439 -166.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.5 mmtt -124.33 -177.82 3.91 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.708 2.803 . . . . 0.0 109.567 166.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.426 HD11 HG21 ' B' ' 95' ' ' VAL . 3.6 mp -122.54 150.24 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 128.706 2.803 . . . . 0.0 107.866 166.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.89 149.13 34.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 128.192 2.597 . . . . 0.0 109.958 170.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -90.53 130.68 36.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 126.886 2.075 . . . . 0.0 108.549 170.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.2 p -122.59 121.55 36.74 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.233 2.833 . . . . 0.0 105.976 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 8.2 t -106.34 144.77 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 122.386 2.357 . . . . 0.0 110.636 -156.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.5 m -88.76 146.13 25.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.885 -2.384 . . . . 0.0 108.774 177.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -56.77 -21.85 31.57 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 117.923 2.564 . . . . 0.0 117.923 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 90' ' ' ILE . 16.0 tt -66.51 -5.72 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 115.145 -2.359 . . . . 0.0 113.786 176.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 40.3 tp -126.96 -3.76 6.4 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 131.107 3.763 . . . . 0.0 112.126 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.455 1.2 t -149.51 14.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 120.735 -1.228 . . . . 0.0 114.263 -167.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -144.72 102.28 3.77 Favored 'General case' 0 N--CA 1.454 -0.274 1 O-C-N 115.713 -4.367 . . . . 0.0 111.176 173.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.363 . . 87.1 4.38 0.36 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 111.63 -2.532 . . . . 0.0 109.92 175.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 p -147.29 151.06 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.376 -1.713 . . . . 0.0 106.376 -167.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 57.91 -105.82 0.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.643 3.177 . . . . 0.0 115.392 158.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 81.7 p -74.06 -20.48 60.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 122.648 2.477 . . . . 0.0 111.44 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 69.9 t60 -141.91 89.12 2.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.356 1.462 . . . . 0.0 111.224 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 63.0 mttt . . . . . 0 C--O 1.256 1.438 0 C-N-CA 127.745 2.418 . . . . 0.0 105.877 157.938 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.29 143.37 52.99 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.683 3.993 . . . . 0.0 111.167 173.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -109.51 114.62 28.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 117.39 -1.29 . . . . 0.0 109.352 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 pt -67.58 155.58 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 O-C-N 125.41 1.694 . . . . 0.0 108.979 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -51.36 -33.64 30.51 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -175.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.6 p -83.42 -17.44 42.17 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 114.973 -2.441 . . . . 0.0 111.031 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.82 -45.67 20.34 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 122.139 2.245 . . . . 0.0 108.516 161.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 6.9 t -58.32 -42.67 87.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 118.114 -2.866 . . . . 0.0 105.635 -177.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.587 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -82.45 -10.65 58.95 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 118.188 -2.82 . . . . 0.0 109.576 -168.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -36.81 20.04 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-O 114.861 -2.495 . . . . 0.0 108.542 172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.18 -34.67 75.43 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.96 2.904 . . . . 0.0 113.144 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.587 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 6.2 m-85 -49.83 -45.96 50.75 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.553 -1.342 . . . . 0.0 114.383 174.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.504 HD21 HG13 ' B' ' 27' ' ' ILE . 93.8 mt -80.68 -20.56 42.69 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 116.456 -1.735 . . . . 0.0 112.266 -179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -82.41 -26.45 32.78 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 124.153 1.93 . . . . 0.0 113.137 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -87.63 -54.66 4.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.88 2.472 . . . . 0.0 114.228 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 16.5 ttt -131.6 109.76 10.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 120.598 1.544 . . . . 0.0 110.761 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -116.58 -26.57 7.0 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 129.069 2.948 . . . . 0.0 114.608 169.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.294 22.9 t70 59.84 64.17 1.34 Allowed 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.922 4.089 . . . . 0.0 107.554 -179.192 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 72.53 -77.91 0.05 Allowed 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 132.507 4.323 . . . . 0.0 107.033 -160.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.402 8.8 t -159.78 24.24 0.18 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 128.405 3.955 . . . . 0.0 116.114 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.33 -34.46 77.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 111.566 -2.561 . . . . 0.0 113.11 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 54.3 mt -99.13 154.44 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 N-CA-C 102.121 -3.288 . . . . 0.0 102.121 171.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -150.07 171.59 16.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 130.768 3.627 . . . . 0.0 112.083 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 8.9 p -61.35 -31.53 50.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 C-N-CA 128.921 2.889 . . . . 0.0 109.442 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -63.12 -47.56 82.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 116.222 -1.847 . . . . 0.0 109.208 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.01 -49.95 74.23 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 128.803 2.841 . . . . 0.0 113.961 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.504 HG13 HD21 ' B' ' 13' ' ' LEU . 4.3 mm -56.19 -32.89 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 1 CA-C-O 110.491 -4.576 . . . . 0.0 115.228 165.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -79.35 -20.84 46.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 O-C-N 128.644 3.715 . . . . 0.0 111.159 -172.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 19.8 mt -82.85 -49.85 9.25 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 114.048 -2.882 . . . . 0.0 108.101 165.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG1' HD11 ' A' ' 34' ' ' LEU 0.368 30.7 t -43.81 -60.21 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 117.036 2.236 . . . . 0.0 117.036 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . 0.276 1.1 p -65.55 10.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 126.595 1.958 . . . . 0.0 112.425 -170.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.351 8.3 t -151.21 26.91 0.69 Allowed 'General case' 0 N--CA 1.451 -0.422 1 C-N-CA 136.01 5.724 . . . . 0.0 110.516 -178.128 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 44.6 p -156.43 -63.55 0.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 123.096 2.68 . . . . 0.0 108.203 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.0 tp -45.05 -50.28 10.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 128.453 2.701 . . . . 0.0 115.43 -175.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -60.32 -35.12 74.89 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 118.922 -2.361 . . . . 0.0 111.118 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -73.16 -50.98 19.59 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.774 2.43 . . . . 0.0 108.683 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 70.1 t -62.75 -44.91 99.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 O-C-N 120.447 -1.408 . . . . 0.0 112.007 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 48.7 mt -71.4 -37.37 71.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.073 -2.267 . . . . 0.0 114.748 176.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.34 79.02 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.055 1.742 . . . . 0.0 114.441 170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -80.8 -13.42 58.98 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.948 0.88 . . . . 0.0 112.55 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -82.5 -35.58 27.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.293 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 16.5 mt -65.44 -19.64 66.02 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 122.671 1.224 . . . . 0.0 112.751 172.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.1 11.43 3.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 116.493 -3.879 . . . . 0.0 110.068 -170.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.623 5.8 t -139.0 41.65 2.11 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.607 163.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.447 62.1 p 71.1 55.53 0.22 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 121.846 2.112 . . . . 0.0 108.304 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.95 169.38 19.93 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 106.657 -2.577 . . . . 0.0 106.657 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -138.82 115.77 10.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.485 1.514 . . . . 0.0 109.69 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.4 t -92.19 109.69 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.851 0 O-C-N 128.063 3.352 . . . . 0.0 104.857 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -88.84 127.25 35.62 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 113.911 -2.947 . . . . 0.0 111.898 155.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.255 39.8 mt -135.56 165.26 25.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.69 2.396 . . . . 0.0 112.055 178.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . 0.285 67.4 m-85 -64.27 111.61 2.69 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 124.059 0.944 . . . . 0.0 112.744 -162.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.265 36.6 m-20 78.29 -0.69 2.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 124.011 1.862 . . . . 0.0 112.983 155.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -96.0 -36.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 119.747 -1.846 . . . . 0.0 111.146 171.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.36 -118.28 3.71 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 128.23 2.824 . . . . 0.0 106.624 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -156.41 146.75 21.46 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 120.028 1.914 . . . . 0.0 112.587 -174.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -108.41 142.84 38.16 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 116.254 -1.831 . . . . 0.0 108.777 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.256 14.9 ptmt -144.99 163.11 35.18 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 126.576 2.423 . . . . 0.0 108.142 -170.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tp -88.65 138.06 31.76 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 114.981 -2.437 . . . . 0.0 108.707 174.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 8.8 p -141.84 131.4 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-O 125.703 2.668 . . . . 0.0 112.86 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 11.9 p -69.97 150.99 46.11 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 117.259 -3.4 . . . . 0.0 110.71 170.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 14.7 m -102.16 148.14 25.77 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 130.638 3.575 . . . . 0.0 101.868 166.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -66.52 127.11 93.19 Favored Pre-proline 0 N--CA 1.449 -0.52 0 CA-C-O 114.572 -2.632 . . . . 0.0 106.559 -167.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -69.01 166.19 27.54 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 O-C-N 128.306 3.793 . . . . 0.0 113.207 176.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . 0.333 30.1 mtm180 -98.18 151.53 20.32 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 130.275 3.43 . . . . 0.0 106.204 171.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -119.67 -143.64 0.36 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.708 173.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.46 170.67 12.04 Favored Glycine 0 CA--C 1.527 0.836 1 C-N-CA 134.155 5.645 . . . . 0.0 110.11 -177.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 41.0 mm -109.63 148.64 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 N-CA-C 104.336 -2.468 . . . . 0.0 104.336 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -83.93 131.13 52.47 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-O 116.336 -1.792 . . . . 0.0 108.398 176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -78.23 -21.47 10.49 Favored 'Trans proline' 0 N--CA 1.459 -0.547 1 C-N-CA 126.855 5.036 . . . . 0.0 114.499 176.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . 0.271 69.9 tttt -74.89 -30.49 61.32 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 129.744 3.218 . . . . 0.0 114.031 -178.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . 0.288 2.0 t -159.98 142.61 13.52 Favored 'General case' 0 N--CA 1.45 -0.441 1 N-CA-C 100.197 -4.001 . . . . 0.0 100.197 175.062 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -68.16 93.2 0.43 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.204 1.401 . . . . 0.0 109.369 -174.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -157.96 154.32 27.6 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 123.966 0.906 . . . . 0.0 110.498 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -87.02 139.93 30.07 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 104.996 -2.224 . . . . 0.0 104.996 -171.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 10.4 mt -98.16 152.52 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 C-N-CA 126.629 1.971 . . . . 0.0 107.98 167.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 31.8 tp60 -159.5 125.19 4.24 Favored 'General case' 0 CA--C 1.518 -0.278 1 CA-C-O 128.522 4.01 . . . . 0.0 104.135 173.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . 0.282 5.9 pt -139.7 140.07 23.84 Favored Pre-proline 0 C--O 1.237 0.436 0 C-N-CA 129.645 3.178 . . . . 0.0 114.962 -177.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -72.12 148.11 49.74 Favored 'Trans proline' 0 N--CA 1.447 -1.248 1 C-N-CA 127.415 5.41 . . . . 0.0 113.401 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.28 . . -113.85 -11.98 12.77 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 114.86 -164.2 12.11 Favored Glycine 0 C--N 1.33 0.222 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.66 177.44 11.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.675 2.79 . . . . 0.0 112.485 -172.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -167.86 177.85 5.5 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 130.049 3.34 . . . . 0.0 110.345 -168.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 21.9 mt -96.15 132.96 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 C-N-CA 126.233 1.813 . . . . 0.0 108.484 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . 0.327 72.2 tttt -113.68 148.78 35.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 129.952 3.301 . . . . 0.0 108.16 172.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 55.7 tp -95.84 149.76 21.17 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 106.258 -1.756 . . . . 0.0 106.258 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.253 1.3 t -142.31 131.36 23.19 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 119.25 -2.156 . . . . 0.0 109.202 155.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 69.7 t -86.04 145.51 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 130.079 3.352 . . . . 0.0 111.503 -163.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 52.4 p -63.98 157.96 23.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 130.736 3.614 . . . . 0.0 115.415 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -69.47 -38.2 77.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 130.109 3.364 . . . . 0.0 106.803 -163.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.02 -50.26 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 118.266 -2.771 . . . . 0.0 110.514 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 tt -59.36 -37.51 78.07 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 129.727 3.211 . . . . 0.0 113.885 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 1.3 t -76.79 -21.67 54.81 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 120.205 1.366 . . . . 0.0 114.267 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.01 -33.04 59.66 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 117.001 -1.476 . . . . 0.0 111.025 169.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.14 -9.26 58.64 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 117.473 2.397 . . . . 0.0 117.473 173.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 83' ' ' ILE . 16.3 t -108.66 -21.24 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 1 O-C-N 129.108 4.005 . . . . 0.0 106.205 -175.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -64.7 -74.48 0.1 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 126.988 2.115 . . . . 0.0 108.961 162.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 75.5 m -88.07 85.3 6.94 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 103.089 -2.93 . . . . 0.0 103.089 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -68.39 141.99 55.55 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 127.165 2.186 . . . . 0.0 107.022 148.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 24.4 pttt . . . . . 0 C--O 1.242 0.66 0 C-N-CA 128.331 2.652 . . . . 0.0 108.34 -174.307 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.6 ttp . . . . . 0 N--CA 1.477 0.896 0 CA-C-O 113.893 -2.956 . . . . 0.0 105.929 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.06 150.84 35.28 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 123.319 2.782 . . . . 0.0 106.133 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -154.16 151.91 29.78 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 130.556 3.542 . . . . 0.0 108.934 174.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.4 mt -78.2 120.66 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 O-C-N 118.01 -2.931 . . . . 0.0 107.87 -172.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -86.85 141.67 28.62 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.528 -1.983 . . . . 0.0 108.948 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 79.4 p -96.31 128.33 43.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 119.432 -2.042 . . . . 0.0 109.463 167.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.7 OUTLIER -145.92 154.57 42.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 -176.409 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.7 t -141.49 -162.99 1.47 Allowed 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 127.431 2.957 . . . . 0.0 104.256 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -38.3 -46.43 1.1 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 127.69 3.614 . . . . 0.0 119.648 -166.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.29 -18.21 65.22 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.497 2.719 . . . . 0.0 116.043 -178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.528 ' HG2' HD13 ' A' ' 7' ' ' LEU . 32.0 tp10 -71.63 -4.29 26.37 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.838 -2.414 . . . . 0.0 112.316 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -82.17 -35.18 28.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.958 2.503 . . . . 0.0 108.483 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.301 27.7 mt -59.58 -33.78 71.88 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -169.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 42.8 pttt -64.74 -39.46 93.66 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 126.057 1.743 . . . . 0.0 109.566 -170.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -80.28 -28.03 38.44 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 125.475 1.51 . . . . 0.0 107.734 177.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 ttt -76.32 -6.26 50.76 Favored 'General case' 0 N--CA 1.444 -0.752 1 C-N-CA 132.073 4.149 . . . . 0.0 110.468 -174.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.9 15.52 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 129.367 3.067 . . . . 0.0 118.268 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -81.88 -32.1 31.18 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 125.863 3.938 . . . . 0.0 111.998 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -71.55 -40.01 70.3 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.257 -1.527 . . . . 0.0 112.379 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.9 p -66.78 99.38 0.61 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 115.538 -2.172 . . . . 0.0 108.676 167.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -140.17 -20.88 0.86 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.069 2.668 . . . . 0.0 111.977 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.0 pt -118.98 -0.39 8.32 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 CA-C-N 121.147 1.794 . . . . 0.0 109.897 170.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.1 pttt -163.65 161.33 23.63 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 117.792 -3.068 . . . . 0.0 104.848 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.268 14.3 p -144.91 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 O-C-N 119.685 -1.884 . . . . 0.0 112.969 -170.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 49.8 mm-40 -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.009 -2.932 . . . . 0.0 106.171 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.65 -21.44 66.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 122.962 2.619 . . . . 0.0 112.601 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.4 mm -68.66 -21.02 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 CA-C-N 120.678 1.581 . . . . 0.0 111.828 -171.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -57.7 -20.68 35.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.932 3.293 . . . . 0.0 110.606 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' B' ' 22' ' ' ILE . 79.0 mt -84.08 -36.49 22.98 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 128.2 2.6 . . . . 0.0 110.657 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.499 HG21 ' HB3' ' B' ' 26' ' ' ASP . 41.2 t -62.82 -45.33 99.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.264 8.5 t -68.68 -30.62 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 127.089 2.156 . . . . 0.0 109.9 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.2 m -68.09 -53.66 23.83 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 124.683 1.239 . . . . 0.0 111.55 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 91.2 p -57.16 -27.68 62.11 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 117.909 -2.994 . . . . 0.0 118.354 -170.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.0 mt -65.15 -37.37 87.17 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 126.183 2.897 . . . . 0.0 111.638 -175.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -77.08 -39.93 47.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 119.558 -1.964 . . . . 0.0 112.378 -174.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -61.19 -24.66 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 130.267 3.427 . . . . 0.0 116.689 -172.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.0 t -82.17 -30.33 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-O 124.124 1.916 . . . . 0.0 113.571 172.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -74.81 -25.82 59.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 116.675 -3.765 . . . . 0.0 110.714 173.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.61 -20.04 64.35 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 115.817 -2.04 . . . . 0.0 110.27 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 30.0 mtpt -108.25 -36.31 6.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.645 2.778 . . . . 0.0 108.8 -177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.09 -46.94 54.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 118.175 -2.828 . . . . 0.0 109.184 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.31 -21.18 62.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 O-C-N 125.124 1.515 . . . . 0.0 111.784 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.1 -27.79 69.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.4 p -103.66 17.56 23.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 116.707 -1.616 . . . . 0.0 112.159 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.424 4.4 m 74.36 25.47 1.69 Allowed 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 126.076 2.11 . . . . 0.0 110.213 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -105.31 139.97 14.88 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.586 1.565 . . . . 0.0 112.725 -160.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.5 145.03 24.81 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.846 -1.539 . . . . 0.0 106.846 -167.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.5 t -135.98 136.35 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 2 O-C-N 130.053 4.596 . . . . 0.0 106.342 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -127.3 124.88 39.79 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 126.635 2.46 . . . . 0.0 105.907 176.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 27.0 mt -115.68 109.71 18.11 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 112.995 -3.383 . . . . 0.0 113.849 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -74.02 142.93 45.72 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 123.801 3.001 . . . . 0.0 107.342 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.488 0.0 OUTLIER 79.59 -4.41 1.99 Allowed 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 128.471 2.709 . . . . 0.0 111.166 178.253 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.4 mt -118.11 -62.59 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 119.406 1.003 . . . . 0.0 110.061 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.9 -173.38 39.11 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 126.513 2.006 . . . . 0.0 111.594 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.305 62.5 pttt -131.87 151.4 51.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.995 2.118 . . . . 0.0 113.352 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -94.37 116.62 29.02 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 111.161 -2.745 . . . . 0.0 113.076 -177.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -92.26 142.52 27.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 125.735 1.897 . . . . 0.0 108.004 -174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -104.39 121.7 43.95 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.1 m -106.89 163.62 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 119.257 -2.152 . . . . 0.0 107.026 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.1 t -115.16 169.86 8.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 127.837 2.455 . . . . 0.0 108.307 168.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 78.9 p -128.68 105.38 8.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 129.083 2.953 . . . . 0.0 105.63 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.282 50.3 pttt -44.33 153.76 0.43 Allowed Pre-proline 0 N--CA 1.448 -0.572 0 C-N-CA 131.108 3.763 . . . . 0.0 114.683 -165.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.05 163.4 30.86 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 O-C-N 123.333 1.175 . . . . 0.0 113.445 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 41.2 mtm105 -136.09 169.45 17.6 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 127.444 2.298 . . . . 0.0 111.514 -168.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.254 12.5 t -127.59 156.97 41.43 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 125.681 2.658 . . . . 0.0 109.863 168.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.18 -167.79 11.13 Favored Glycine 0 C--N 1.336 0.579 0 N-CA-C 105.66 -2.976 . . . . 0.0 105.66 163.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.443 HD13 HG21 ' A' ' 67' ' ' ILE . 48.0 pt -125.71 159.74 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 C-N-CA 124.34 1.056 . . . . 0.0 108.417 175.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -72.21 146.28 89.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.653 -2.351 . . . . 0.0 104.653 169.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -90.58 -7.04 4.16 Favored 'Trans proline' 0 N--CA 1.452 -0.919 1 C-N-CA 127.613 5.542 . . . . 0.0 116.154 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -132.65 9.02 4.24 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.174 -2.829 . . . . 0.0 115.641 -176.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . 0.281 73.7 p -156.19 156.27 33.87 Favored 'General case' 0 N--CA 1.444 -0.769 1 C-N-CA 133.034 4.533 . . . . 0.0 108.112 173.995 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -83.15 45.29 1.01 Allowed 'General case' 0 N--CA 1.451 -0.406 2 O-C-N 115.614 -4.429 . . . . 0.0 115.037 173.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -107.24 133.34 51.96 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 130.214 3.405 . . . . 0.0 112.414 -174.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE 0.329 27.8 tttt -79.29 159.83 27.07 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 125.455 1.722 . . . . 0.0 110.13 -172.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' LYS . 11.2 mm -133.17 130.18 57.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 O-C-N 120.419 -1.425 . . . . 0.0 110.228 176.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.283 7.8 mm100 -95.52 125.43 40.12 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.354 -3.213 . . . . 0.0 106.083 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mt -110.07 140.42 22.34 Favored Pre-proline 0 N--CA 1.446 -0.667 0 O-C-N 128.691 3.744 . . . . 0.0 104.142 179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -79.48 158.79 25.68 Favored 'Trans proline' 0 N--CA 1.443 -1.476 0 O-C-N 125.845 2.498 . . . . 0.0 115.868 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.17 164.54 12.98 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 116.682 -2.007 . . . . 0.0 113.689 158.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -126.35 174.83 17.9 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 128.36 3.537 . . . . 0.0 108.352 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . 0.349 17.7 pttt -144.75 132.04 20.66 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.776 1.63 . . . . 0.0 110.427 -165.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -130.14 167.89 17.65 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.608 0.763 . . . . 0.0 109.522 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.8 mt -109.96 152.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -146.59 140.65 26.23 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' B' ' 85' ' ' LEU . 26.6 tp -88.78 135.7 33.38 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 127.178 2.191 . . . . 0.0 108.156 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.251 20.7 p -118.76 123.09 43.97 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 126.537 2.398 . . . . 0.0 109.894 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.5 t -112.3 137.69 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 121.388 1.904 . . . . 0.0 107.474 -164.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.1 m -78.91 138.28 38.03 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 112.817 -1.992 . . . . 0.0 108.392 -173.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.374 9.5 pttp -39.77 -39.41 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 130.285 3.434 . . . . 0.0 119.276 173.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.56 -38.67 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 125.936 1.695 . . . . 0.0 114.072 -176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 12.3 tp -86.75 -10.83 52.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.408 1.883 . . . . 0.0 109.995 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.316 4.0 t -147.02 39.62 1.03 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 124.562 3.346 . . . . 0.0 114.819 -163.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . 0.373 0.9 OUTLIER -157.1 138.44 13.8 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 101.901 -3.37 . . . . 0.0 101.901 172.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 66.69 -42.62 0.41 Allowed 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.861 2.464 . . . . 0.0 115.186 175.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.3 p -153.07 162.58 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 O-C-N 119.418 -2.051 . . . . 0.0 109.216 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.464 59.6 m-20 86.16 -110.47 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 128.933 2.893 . . . . 0.0 106.727 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.4 p -71.09 -13.17 61.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 125.206 2.432 . . . . 0.0 114.724 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.0 t60 -152.21 54.91 0.82 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.075 -2.266 . . . . 0.0 107.31 -163.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 tptt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 127.771 2.428 . . . . 0.0 106.311 168.039 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 121.22 17.43 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 115.379 -2.248 . . . . 0.0 116.026 172.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 23.2 mmtp -86.32 105.77 16.91 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 124.939 3.518 . . . . 0.0 110.528 -166.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 27.8 pt -90.53 166.6 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 1 C-N-CA 132.901 4.48 . . . . 0.0 106.777 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.27 35.8 ttpt -41.46 -45.32 3.14 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 129.756 3.223 . . . . 0.0 117.964 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 5.0 p -83.05 -38.75 22.13 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 121.416 -0.803 . . . . 0.0 108.928 -169.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -64.2 -27.12 68.84 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 128.242 2.617 . . . . 0.0 114.547 172.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 54.3 m -97.61 1.48 48.83 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 -170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.39 94.41 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 128.774 2.829 . . . . 0.0 112.569 -166.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.263 . . -97.07 -6.1 35.96 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 116.614 -1.66 . . . . 0.0 109.437 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -73.49 -27.99 61.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 123.188 1.471 . . . . 0.0 107.932 -176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -71.92 -41.11 68.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -82.37 -29.03 31.16 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 125.377 1.673 . . . . 0.0 113.692 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -61.22 -31.39 71.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.533 1.933 . . . . 0.0 110.435 164.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -81.24 -57.33 3.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.213 -2.179 . . . . 0.0 115.114 172.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 24.7 ttt -137.41 118.03 13.95 Favored 'General case' 0 N--CA 1.442 -0.852 0 O-C-N 119.763 -1.835 . . . . 0.0 111.453 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -129.26 -29.11 2.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 21.1 t70 69.8 57.38 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 129.013 3.946 . . . . 0.0 108.016 -174.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . 0.415 24.5 tp10 65.53 -87.79 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.773 2.429 . . . . 0.0 109.438 -160.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.1 t -149.81 37.05 0.71 Allowed 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 120.547 -1.346 . . . . 0.0 111.289 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -65.27 -57.77 7.61 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.759 2.423 . . . . 0.0 112.313 161.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.482 HG23 HG22 ' A' ' 30' ' ' VAL 0.311 55.0 mt -94.67 135.19 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 118.698 -2.501 . . . . 0.0 105.981 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -132.75 166.05 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 129.792 3.237 . . . . 0.0 112.578 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.98 -30.5 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 127.842 2.457 . . . . 0.0 111.522 -172.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -38.61 -47.5 1.33 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.728 1.611 . . . . 0.0 113.801 160.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.499 ' HB3' HG21 ' A' ' 30' ' ' VAL . 65.7 m-20 -77.67 -37.76 49.1 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.721 1.608 . . . . 0.0 109.69 -172.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 15.8 mm -58.67 -46.37 90.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 130.184 3.394 . . . . 0.0 111.003 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 87.7 mtt180 -63.96 -17.04 62.88 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.91 -45.88 10.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.87 -1.769 . . . . 0.0 112.359 166.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.437 ' CG1' HD22 ' B' ' 34' ' ' LEU . 65.9 t -85.81 -25.29 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.529 -1.357 . . . . 0.0 108.084 -161.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 p -71.35 -15.04 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 122.737 2.517 . . . . 0.0 113.851 -177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -128.06 29.17 5.43 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.979 2.111 . . . . 0.0 110.588 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.393 55.1 p -154.28 -31.9 0.11 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.686 2.847 . . . . 0.0 118.686 174.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.437 HD22 ' CG1' ' B' ' 30' ' ' VAL . 14.8 tp -56.67 -34.42 67.36 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 120.121 1.328 . . . . 0.0 114.165 -174.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 15.2 pm0 -72.22 -38.48 68.98 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 128.188 3.852 . . . . 0.0 115.065 -178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtt -64.94 -41.43 95.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 116.388 -3.945 . . . . 0.0 113.209 172.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 47.7 t -76.05 -24.0 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 115.997 -1.954 . . . . 0.0 110.49 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.32 -27.46 25.92 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 124.325 3.239 . . . . 0.0 107.97 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.522 ' HA ' HD12 ' B' ' 42' ' ' LEU . . . -68.49 -31.21 70.33 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 130.384 3.474 . . . . 0.0 111.394 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -54.44 -44.91 72.88 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.041 2.536 . . . . 0.0 114.355 160.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -79.98 -30.64 39.76 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 120.132 -1.605 . . . . 0.0 113.422 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' B' ' 39' ' ' ALA . 14.9 mt -63.68 -38.8 92.48 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.4 -2.94 0.05 Allowed 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 130.245 3.418 . . . . 0.0 117.981 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.338 8.8 t -143.25 20.95 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 115.862 -2.018 . . . . 0.0 108.523 179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.629 35.6 p 88.66 92.0 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 114.693 -2.575 . . . . 0.0 104.748 173.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -123.4 121.35 4.52 Favored Glycine 0 C--N 1.345 1.078 0 N-CA-C 104.554 -3.418 . . . . 0.0 104.554 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -87.81 91.65 8.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.783 1.278 . . . . 0.0 109.038 160.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.43 HG22 HD11 ' A' ' 7' ' ' LEU . 88.1 t -73.56 95.08 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 C-N-CA 127.847 2.459 . . . . 0.0 109.644 175.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . 0.322 64.2 mtt180 -89.57 120.41 30.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 -175.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.05 144.74 51.51 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 126.23 1.812 . . . . 0.0 107.268 -174.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -76.01 102.69 5.74 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 128.104 3.377 . . . . 0.0 110.01 -162.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.301 85.0 m-20 95.49 -19.26 0.07 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 130.931 3.692 . . . . 0.0 112.534 170.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 13.6 tt -82.48 -35.27 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 133.789 4.836 . . . . 0.0 110.291 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 131.21 -122.93 3.61 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 108.646 -1.782 . . . . 0.0 108.646 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -146.16 153.34 40.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 100.87 -3.752 . . . . 0.0 100.87 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -112.98 149.69 32.93 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -139.42 153.28 47.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 127.727 2.411 . . . . 0.0 109.856 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.317 4.0 tp -91.32 138.61 31.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 125.173 2.416 . . . . 0.0 111.375 159.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 96.9 t -110.09 115.98 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.6 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 31.8 p -69.61 135.36 49.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.482 1.29 . . . . 0.0 114.482 169.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.6 m -86.29 144.27 27.48 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 119.123 -2.236 . . . . 0.0 112.336 173.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.276 64.6 tttt -53.1 100.2 0.22 Allowed Pre-proline 0 N--CA 1.448 -0.557 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.38 165.7 31.65 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 125.292 3.995 . . . . 0.0 113.378 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 25.9 mtm105 -98.47 156.72 16.63 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.261 1.3 t -134.63 131.57 37.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.778 2.431 . . . . 0.0 109.846 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -133.86 -179.51 16.46 Favored Glycine 0 C--N 1.339 0.743 0 C-N-CA 127.205 2.336 . . . . 0.0 109.862 169.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 17.5 mm -118.69 132.31 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 C-N-CA 127.761 2.424 . . . . 0.0 108.592 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -80.39 127.03 77.42 Favored Pre-proline 0 N--CA 1.45 -0.448 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -78.13 -17.3 13.52 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.252 2.635 . . . . 0.0 112.761 -175.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -112.11 -10.55 13.88 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 126.0 1.72 . . . . 0.0 113.593 -164.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.8 t -149.03 176.6 10.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.908 -1.515 . . . . 0.0 106.908 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -93.33 30.74 1.62 Allowed 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.761 3.225 . . . . 0.0 113.981 -156.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -118.5 151.36 37.99 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 129.084 2.954 . . . . 0.0 114.493 -160.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 78.1 mttt -93.97 145.69 24.47 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.987 1.715 . . . . 0.0 109.816 165.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 68.0 mt -111.99 133.46 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 100.944 -3.725 . . . . 0.0 100.944 177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.01 133.01 55.15 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.345 -1.312 . . . . 0.0 108.525 168.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.61 123.66 31.04 Favored Pre-proline 0 N--CA 1.452 -0.326 0 O-C-N 127.006 2.692 . . . . 0.0 105.893 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -76.28 160.27 36.05 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.597 4.198 . . . . 0.0 112.613 -169.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.347 . . -113.97 -33.3 5.78 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 130.319 3.448 . . . . 0.0 109.943 174.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 120.58 -155.27 16.26 Favored Glycine 0 CA--C 1.525 0.677 0 CA-C-O 126.393 3.218 . . . . 0.0 109.177 157.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 29.4 pttt -159.87 150.27 18.8 Favored 'General case' 0 N--CA 1.446 -0.662 1 O-C-N 114.899 -4.883 . . . . 0.0 108.343 -170.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -153.92 159.34 41.68 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 129.572 3.149 . . . . 0.0 112.229 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 13.5 mt -75.38 131.64 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 126.866 3.222 . . . . 0.0 105.01 173.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 9.7 tttp -112.38 153.74 26.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 112.753 -2.021 . . . . 0.0 107.511 163.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' LEU 0.292 36.4 tp -94.61 164.6 12.9 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 129.125 2.97 . . . . 0.0 105.048 169.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.333 5.1 t -160.99 108.95 1.54 Allowed 'General case' 0 N--CA 1.44 -0.925 1 C-N-CA 132.286 4.235 . . . . 0.0 109.31 157.474 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.42 162.26 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-O 114.636 -2.602 . . . . 0.0 113.626 -167.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.8 p -67.45 -169.06 0.09 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 127.231 2.832 . . . . 0.0 112.32 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -74.82 -28.74 60.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 119.372 -2.08 . . . . 0.0 113.082 168.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -56.27 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 128.033 3.778 . . . . 0.0 110.326 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 mt -70.33 0.07 7.17 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 130.475 3.51 . . . . 0.0 111.378 172.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.5 m -100.83 -51.67 3.5 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 125.58 3.809 . . . . 0.0 101.47 175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -56.44 -53.36 58.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 130.483 3.513 . . . . 0.0 113.539 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.22 -20.53 60.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 125.4 2.524 . . . . 0.0 113.494 -170.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.06 -19.2 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 127.035 2.134 . . . . 0.0 115.054 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -86.43 -21.3 27.17 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 126.616 3.103 . . . . 0.0 113.871 173.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.8 t -153.32 92.11 1.57 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 129.4 3.08 . . . . 0.0 105.727 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -70.28 132.0 45.03 Favored 'General case' 0 N--CA 1.439 -0.983 0 C-N-CA 128.818 2.847 . . . . 0.0 107.889 177.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 17.1 mttp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 128.121 2.569 . . . . 0.0 110.265 169.84 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.6 ttm . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.19 112.08 12.28 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.91 1.684 . . . . 0.0 107.012 174.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -117.44 130.12 56.27 Favored 'General case' 0 N--CA 1.439 -0.977 0 O-C-N 118.84 -2.412 . . . . 0.0 109.903 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mp -80.97 141.99 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 131.641 3.977 . . . . 0.0 104.336 -177.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -78.99 142.66 36.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 127.199 2.2 . . . . 0.0 110.298 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.6 p -115.85 137.47 52.07 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 126.852 2.595 . . . . 0.0 107.581 166.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.251 2.2 pp -141.47 -177.74 5.29 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 123.33 2.786 . . . . 0.0 110.089 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.2 t -153.79 -158.23 0.85 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 125.863 2.744 . . . . 0.0 103.616 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.21 -23.0 63.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 131.654 3.982 . . . . 0.0 117.344 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.07 -47.29 53.63 Favored 'General case' 0 C--O 1.237 0.402 1 C-N-CA 131.98 4.112 . . . . 0.0 116.532 166.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.9 -11.65 61.08 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 129.707 3.203 . . . . 0.0 111.626 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -83.61 -23.37 31.93 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.973 172.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -77.11 -10.17 59.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 117.397 -1.287 . . . . 0.0 108.956 -174.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -81.55 -19.79 41.3 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 125.274 3.67 . . . . 0.0 111.205 174.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -85.5 -50.31 7.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 127.134 2.173 . . . . 0.0 109.593 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 5.7 ttt -63.42 12.5 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.652 1 C-N-CA 132.228 4.211 . . . . 0.0 116.467 166.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.99 -1.85 18.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.219 2.607 . . . . 0.0 114.225 -168.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -100.9 -44.6 5.7 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 116.683 -3.761 . . . . 0.0 110.675 167.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -76.5 1.34 16.89 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 124.718 1.207 . . . . 0.0 112.457 -176.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.2 p -101.07 103.8 14.91 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 122.537 1.16 . . . . 0.0 110.238 159.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.414 19.4 p30 -142.05 -24.33 0.68 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.005 1.722 . . . . 0.0 112.632 -172.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.8 mt -108.78 -27.76 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 O-C-N 119.161 -2.212 . . . . 0.0 111.421 168.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -140.31 168.58 19.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.928 172.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p -158.08 -64.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.449 2.699 . . . . 0.0 110.749 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -51.99 -39.73 59.86 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 121.469 3.877 . . . . 0.0 121.469 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . 0.272 28.7 m-20 -83.66 -10.67 58.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.202 -2.272 . . . . 0.0 110.242 -171.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.7 mm -67.22 -28.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 128.607 2.763 . . . . 0.0 108.435 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtm180 -56.51 -42.07 77.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.797 1.639 . . . . 0.0 110.604 168.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 43.4 mt -70.1 -43.45 71.06 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 120.542 1.519 . . . . 0.0 109.052 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.277 56.7 t -42.47 -50.21 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 116.451 2.019 . . . . 0.0 116.451 169.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.4 t -73.29 -31.88 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 126.349 1.86 . . . . 0.0 113.885 -175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.7 m -66.92 -38.25 85.85 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 126.169 2.168 . . . . 0.0 110.765 -178.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 84.0 p -63.55 -30.77 71.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 128.142 2.577 . . . . 0.0 108.088 -167.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mp -65.29 -35.76 82.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 130.267 3.427 . . . . 0.0 109.947 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -84.28 -22.66 30.65 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.586 1.554 . . . . 0.0 111.452 -175.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -75.86 -31.04 59.12 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.892 1.677 . . . . 0.0 106.884 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -71.64 -21.03 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 CA-C-N 122.357 2.344 . . . . 0.0 111.892 -178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.1 mt -85.0 -51.02 6.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.01 -29.73 3.72 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 120.267 3.432 . . . . 0.0 120.267 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 tttt -90.48 -53.06 4.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 131.031 3.732 . . . . 0.0 111.243 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.53 -43.26 81.2 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.048 1.339 . . . . 0.0 112.856 -176.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mt -76.19 -20.75 57.22 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 114.698 -2.572 . . . . 0.0 110.92 -177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.59 -25.63 50.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 126.7 3.143 . . . . 0.0 112.55 174.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . 0.274 81.5 p -96.64 15.88 20.5 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 118.664 -2.523 . . . . 0.0 114.492 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 27.0 m 60.47 51.15 5.4 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.828 3.251 . . . . 0.0 108.711 164.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -130.05 147.16 17.97 Favored Glycine 0 N--CA 1.443 -0.871 1 C-N-CA 132.76 4.981 . . . . 0.0 108.373 -165.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.0 tt0 -115.01 140.28 49.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.106 -3.585 . . . . 0.0 109.645 -160.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.3 t -120.49 131.92 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 O-C-N 126.162 2.164 . . . . 0.0 107.775 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -88.24 129.41 35.36 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.984 1.427 . . . . 0.0 109.663 164.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.42 115.23 29.29 Favored 'General case' 0 CA--C 1.515 -0.38 1 C-N-CA 131.81 4.044 . . . . 0.0 103.988 -170.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.91 129.39 39.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 112.016 -175.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.93 11.43 5.27 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.927 2.091 . . . . 0.0 111.699 177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -131.28 -56.42 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 129.035 2.934 . . . . 0.0 111.493 -171.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.11 -134.27 6.06 Favored Glycine 0 C--N 1.344 1.025 0 C-N-CA 124.509 1.052 . . . . 0.0 111.194 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.389 50.7 pttt -137.86 -174.64 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 176.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -97.72 133.26 42.49 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 115.258 -2.306 . . . . 0.0 111.539 150.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -94.49 128.45 41.08 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 126.976 2.672 . . . . 0.0 105.527 173.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -97.04 97.2 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 1 C-N-CA 133.26 4.624 . . . . 0.0 102.187 -176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 t -93.35 134.47 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 124.196 0.935 . . . . 0.0 108.972 -176.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.532 12.5 t -136.0 124.34 23.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.0 p -88.5 118.5 28.19 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 125.168 2.413 . . . . 0.0 106.153 163.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -50.33 162.89 0.48 Allowed Pre-proline 0 N--CA 1.442 -0.855 1 O-C-N 115.225 -4.672 . . . . 0.0 115.058 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -75.99 149.71 33.12 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 CA-C-O 117.379 -1.175 . . . . 0.0 109.54 163.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -142.34 176.51 8.94 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 126.631 1.973 . . . . 0.0 110.055 173.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.305 7.9 t -135.29 125.22 25.72 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 128.613 2.765 . . . . 0.0 110.733 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.95 -168.7 16.54 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 106.493 -2.643 . . . . 0.0 106.493 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 pt -132.41 148.03 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 1 C-N-CA 133.792 4.837 . . . . 0.0 107.227 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -57.46 133.28 81.8 Favored Pre-proline 0 N--CA 1.445 -0.675 0 O-C-N 127.109 2.756 . . . . 0.0 115.516 158.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.64 -20.73 9.1 Favored 'Trans proline' 0 N--CA 1.446 -1.277 0 O-C-N 116.383 -2.482 . . . . 0.0 115.575 -172.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -102.06 -17.01 16.25 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 121.854 2.116 . . . . 0.0 116.175 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 51.1 p -134.63 159.33 41.56 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.088 2.155 . . . . 0.0 109.528 176.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -86.04 103.92 15.17 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.936 -2.246 . . . . 0.0 104.936 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -158.2 128.29 6.06 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 103.547 -2.76 . . . . 0.0 103.547 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -84.5 133.42 34.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 23.0 mm -124.74 120.8 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 C-N-CA 126.837 2.055 . . . . 0.0 105.912 -177.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . 0.314 44.3 mm-40 -85.93 141.9 29.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.392 -2.693 . . . . 0.0 111.428 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 63.3 mt -106.41 115.62 60.53 Favored Pre-proline 0 N--CA 1.439 -0.986 0 C-N-CA 126.516 1.926 . . . . 0.0 107.851 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -76.83 162.7 32.15 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.376 3.384 . . . . 0.0 112.065 -168.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.53 132.11 45.02 Favored 'General case' 0 N--CA 1.451 -0.389 1 O-C-N 129.6 4.313 . . . . 0.0 108.252 174.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -127.48 157.3 20.83 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 127.393 2.425 . . . . 0.0 115.011 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -153.72 148.99 27.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.294 2.638 . . . . 0.0 115.646 -165.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -136.63 154.73 50.57 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.926 1.29 . . . . 0.0 109.166 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mt -92.34 138.49 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 C-N-CA 127.545 2.338 . . . . 0.0 107.745 166.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -131.86 121.37 23.95 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.75 3.22 . . . . 0.0 106.407 167.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.7 tp -68.76 135.25 50.96 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 116.08 -1.914 . . . . 0.0 108.395 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.25 35.9 p -129.39 90.25 2.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 123.15 2.705 . . . . 0.0 110.522 178.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 96.7 t -86.84 128.68 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.8 t -81.42 161.53 23.68 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 126.305 1.842 . . . . 0.0 110.064 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -31.37 -41.18 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 131.56 3.944 . . . . 0.0 118.062 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.7 tt -49.84 -9.72 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 C-N-CA 131.046 3.738 . . . . 0.0 117.205 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.8 tp -140.88 -12.16 0.98 Allowed 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.115 -2.866 . . . . 0.0 113.296 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.251 6.5 t -147.2 29.14 0.98 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 117.203 -1.379 . . . . 0.0 114.51 -165.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -159.77 104.49 1.56 Allowed 'General case' 0 C--O 1.221 -0.428 0 O-C-N 126.72 2.513 . . . . 0.0 108.429 177.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 60.42 29.22 18.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 131.221 3.808 . . . . 0.0 107.796 -178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -162.63 150.19 3.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 1 O-C-N 115.754 -4.341 . . . . 0.0 105.655 -169.329 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 44.19 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.712 1 N-CA-C 123.532 4.641 . . . . 0.0 123.532 170.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.7 p -87.44 -28.0 22.37 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.179 2.192 . . . . 0.0 110.159 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.417 ' ND1' ' HG2' ' B' ' 81' ' ' LYS . 23.8 t60 -149.31 105.22 3.46 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 -171.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.254 32.5 pttt . . . . . 0 C--O 1.253 1.253 1 C-N-CA 132.133 4.173 . . . . 0.0 114.221 -170.93 . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.23 138.54 34.56 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 128.331 3.919 . . . . 0.0 108.526 174.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -80.75 112.71 18.37 Favored 'General case' 0 N--CA 1.446 -0.654 1 O-C-N 115.669 -4.394 . . . . 0.0 108.79 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 17.8 pt -98.69 161.06 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 128.594 2.758 . . . . 0.0 104.49 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -38.69 -52.99 1.67 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.532 2.333 . . . . 0.0 116.282 -175.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 4.0 p -42.48 -50.3 5.24 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 129.08 2.952 . . . . 0.0 116.349 179.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 27.1 mt -73.46 -41.93 62.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.475 -2.016 . . . . 0.0 110.152 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 67.2 m -69.1 -31.64 70.5 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.296 1.038 . . . . 0.0 110.281 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.443 ' HA ' ' CD2' ' B' ' 12' ' ' TYR . . . -65.93 -15.47 63.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 127.411 2.284 . . . . 0.0 114.901 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.83 -44.26 9.05 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 127.082 2.153 . . . . 0.0 113.159 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -63.89 -27.15 68.96 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 128.361 3.538 . . . . 0.0 111.467 -177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' B' ' 9' ' ' ALA . 13.9 m-85 -69.32 -42.11 75.8 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.593 -1.942 . . . . 0.0 106.875 -173.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -81.01 -10.82 59.66 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.084 1.353 . . . . 0.0 113.924 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -82.98 -39.1 21.78 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.903 -2.373 . . . . 0.0 109.449 170.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 tp10 -82.87 -31.32 28.01 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 17.3 ttt -161.05 104.66 1.32 Allowed 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.286 . . -112.53 -26.66 8.56 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 171.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.371 33.4 t70 69.51 51.41 0.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.997 2.119 . . . . 0.0 108.391 178.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 76.35 -88.71 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 129.081 2.952 . . . . 0.0 109.746 -164.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.8 t -154.91 47.33 0.54 Allowed 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.609 1.964 . . . . 0.0 108.487 167.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -79.06 -35.98 41.63 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.681 -2.34 . . . . 0.0 104.681 169.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -100.14 133.55 42.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 104.001 -2.592 . . . . 0.0 104.001 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -140.29 166.02 25.81 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 123.563 1.649 . . . . 0.0 109.189 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 p -53.6 -37.68 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-N 113.798 -1.547 . . . . 0.0 113.664 177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -52.23 -31.84 34.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 115.273 -2.299 . . . . 0.0 111.841 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -96.57 -28.28 14.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 127.87 3.231 . . . . 0.0 113.446 -169.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.75 -31.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.441 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -62.56 -29.93 70.94 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.378 1.471 . . . . 0.0 114.505 -177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mp -81.48 -45.64 15.69 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 122.15 2.25 . . . . 0.0 106.133 172.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.331 13.7 t -54.65 -62.27 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 117.58 2.437 . . . . 0.0 117.58 -175.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 5.9 p -61.23 -9.17 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 N-CA-C 115.785 1.772 . . . . 0.0 115.785 -170.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . 0.436 ' HA ' HE22 ' B' ' 35' ' ' GLN . 7.3 t -119.94 12.04 11.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.618 1.567 . . . . 0.0 114.303 177.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.257 58.5 p -126.21 -46.31 1.65 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 131.205 3.802 . . . . 0.0 114.765 176.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.8 tp -63.88 -42.68 97.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.288 -2.133 . . . . 0.0 115.911 -153.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.436 HE22 ' HA ' ' B' ' 32' ' ' THR 0.256 10.5 pm0 -48.74 -29.45 4.5 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 128.237 3.461 . . . . 0.0 116.987 166.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mttm -98.84 -38.01 9.21 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.099 -175.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.09 -40.48 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 O-C-N 124.557 1.161 . . . . 0.0 110.288 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.08 -24.91 66.8 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 129.058 2.943 . . . . 0.0 111.224 167.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.7 -30.99 67.71 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 123.572 2.897 . . . . 0.0 110.766 -172.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -74.65 -25.71 59.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 130.108 3.363 . . . . 0.0 118.139 169.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.25 -29.76 57.61 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 125.992 2.806 . . . . 0.0 111.3 166.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 mt -74.11 -45.66 47.62 Favored 'General case' 0 C--O 1.239 0.504 0 O-C-N 118.052 -2.905 . . . . 0.0 110.497 179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.332 . . -53.04 -25.68 13.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 129.78 3.232 . . . . 0.0 114.521 174.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -111.16 19.34 18.47 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 120.154 -1.591 . . . . 0.0 113.93 169.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 63.2 p 63.07 89.58 0.09 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 128.188 2.595 . . . . 0.0 111.863 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -124.42 120.65 4.12 Favored Glycine 0 CA--C 1.523 0.566 1 N-CA-C 102.44 -4.264 . . . . 0.0 102.44 165.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -61.23 123.02 16.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.372 2.586 . . . . 0.0 108.667 164.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.24 110.78 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 102.061 -3.311 . . . . 0.0 102.061 -172.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 53.1 mtt180 -107.46 66.16 0.66 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.196 0.998 . . . . 0.0 111.198 -172.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.265 13.5 mt -82.77 146.99 28.67 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -173.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.03 129.32 40.33 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 127.237 2.215 . . . . 0.0 112.96 -173.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.496 20.6 m-20 92.81 -38.5 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.656 2.782 . . . . 0.0 112.988 164.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 tp -66.66 -46.09 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.623 0 C-N-CA 124.233 1.013 . . . . 0.0 108.584 176.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.57 -127.66 6.28 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -165.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -133.58 138.67 46.13 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 120.447 -1.619 . . . . 0.0 111.87 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -95.91 157.17 16.02 Favored 'General case' 0 N--CA 1.451 -0.413 1 CA-C-O 128.972 4.225 . . . . 0.0 104.067 164.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -167.62 149.12 5.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 118.608 -2.558 . . . . 0.0 116.54 -173.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.1 tp -90.19 124.86 35.19 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 101.948 -3.353 . . . . 0.0 101.948 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 71.6 t -126.5 132.08 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 102.555 -3.128 . . . . 0.0 102.555 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 23.1 p -88.94 128.1 35.68 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.585 1.954 . . . . 0.0 111.651 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -80.14 135.55 36.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 131.098 3.759 . . . . 0.0 110.165 -173.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . 0.402 12.1 tttt -41.44 119.31 1.89 Allowed Pre-proline 0 CA--C 1.513 -0.459 0 C-N-CA 128.671 2.788 . . . . 0.0 117.614 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -78.64 175.84 10.56 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 124.841 3.694 . . . . 0.0 110.812 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -100.2 159.89 14.76 Favored 'General case' 0 C--N 1.328 -0.347 1 C-N-CA 132.022 4.129 . . . . 0.0 107.717 159.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 15.1 t -145.59 128.24 16.17 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 -167.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -131.59 -173.04 13.23 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 119.656 -1.259 . . . . 0.0 112.764 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 mm -119.54 142.58 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.185 2.194 . . . . 0.0 112.249 173.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -74.46 136.46 74.92 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 103.498 -2.779 . . . . 0.0 103.498 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -83.86 3.05 7.9 Favored 'Trans proline' 0 N--CA 1.447 -1.224 1 C-N-CA 125.543 4.162 . . . . 0.0 111.472 174.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 27.7 tptt -122.52 -16.04 7.39 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 121.376 1.898 . . . . 0.0 113.158 -168.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 3.9 t -160.83 160.37 31.05 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.591 3.557 . . . . 0.0 107.93 -167.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -89.94 49.19 1.68 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.147 2.179 . . . . 0.0 108.277 -174.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -113.92 156.98 23.02 Favored 'General case' 0 N--CA 1.451 -0.421 1 C-N-CA 133.993 4.917 . . . . 0.0 109.427 169.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -80.44 171.75 14.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 129.101 2.96 . . . . 0.0 107.653 168.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 96.6 mt -129.93 129.14 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 101.677 -3.453 . . . . 0.0 101.677 159.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -103.42 135.99 44.0 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 104.869 -2.271 . . . . 0.0 104.869 179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.19 98.08 42.24 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 128.242 2.617 . . . . 0.0 112.907 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.42 164.1 36.63 Favored 'Trans proline' 0 N--CA 1.451 -0.974 1 C-N-CA 126.276 4.651 . . . . 0.0 111.433 -170.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -114.35 -48.05 2.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -178.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 133.57 -147.33 18.99 Favored Glycine 0 C--O 1.223 -0.556 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HG2' ' ND1' ' A' ' 98' ' ' HIS . 25.7 pttt -165.97 149.25 7.58 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.282 1.033 . . . . 0.0 112.756 -160.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . 0.322 25.3 tttt -141.35 156.96 45.77 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 85.9 mt -75.71 129.87 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 CA-C-O 125.695 2.664 . . . . 0.0 105.406 164.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -128.21 160.42 32.15 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.262 2.625 . . . . 0.0 107.426 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.43 154.66 45.82 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.226 1.411 . . . . 0.0 110.95 172.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.254 3.1 t -135.87 130.72 34.3 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 117.796 -3.065 . . . . 0.0 108.676 162.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 2.2 m -92.63 165.17 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 118.597 -2.564 . . . . 0.0 112.012 -163.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 31.2 p -65.14 169.64 5.32 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 131.237 3.815 . . . . 0.0 116.185 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . 0.314 33.4 tttm -72.85 -30.28 63.88 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 127.228 2.211 . . . . 0.0 106.974 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 62.7 mt -54.29 -58.97 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 126.044 1.737 . . . . 0.0 112.336 164.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 22.4 mt -72.7 -38.06 67.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 117.0 2.222 . . . . 0.0 117.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 85.5 m -65.21 -52.58 53.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 119.528 -1.982 . . . . 0.0 114.163 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.78 -22.52 62.37 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 117.763 -1.575 . . . . 0.0 109.217 -175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.97 -20.97 26.5 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 115.849 -2.024 . . . . 0.0 110.958 -177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 2.1 t -67.97 -33.78 63.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 115.119 -2.372 . . . . 0.0 107.352 168.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -66.97 -57.26 7.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 124.108 3.14 . . . . 0.0 113.738 161.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 5.6 t -155.15 94.23 1.6 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 123.002 1.382 . . . . 0.0 108.959 -165.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -66.13 136.64 56.23 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.92 1.288 . . . . 0.0 111.74 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' B' ' 99' ' ' LYS . 9.0 ptpt . . . . . 0 C--O 1.258 1.535 0 C-N-CA 129.494 3.118 . . . . 0.0 107.202 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 121.668 0.747 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.24 79.65 7.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 125.941 2.781 . . . . 0.0 110.958 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -84.26 149.72 25.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.377 -2.647 . . . . 0.0 105.848 172.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.1 mm -84.83 130.55 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 129.212 3.005 . . . . 0.0 110.093 169.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -94.05 141.15 28.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 -173.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.9 p -120.53 149.83 41.81 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.074 -2.267 . . . . 0.0 107.328 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.415 HD13 ' HG3' ' B' ' 41' ' ' GLU . 0.6 OUTLIER -148.24 173.14 13.31 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 125.626 2.631 . . . . 0.0 105.438 -171.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -151.83 -161.03 1.23 Allowed 'General case' 0 N--CA 1.45 -0.472 2 O-C-N 112.051 -6.655 . . . . 0.0 111.063 170.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.94 -11.77 59.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 128.307 2.643 . . . . 0.0 115.425 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.9 56.24 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 119.06 -2.275 . . . . 0.0 112.44 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -80.99 -20.99 40.66 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.521 1.928 . . . . 0.0 111.501 174.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -77.17 -33.74 56.48 Favored 'General case' 0 CA--C 1.521 -0.167 0 O-C-N 120.243 -1.535 . . . . 0.0 110.636 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.0 mt -65.99 -38.33 88.21 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 117.568 2.432 . . . . 0.0 117.568 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 14.7 pttp -70.18 -16.92 63.14 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.04 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -79.76 -34.89 39.47 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 117.882 -3.011 . . . . 0.0 110.456 169.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 94.3 mmm -84.11 -3.51 58.14 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . 0.449 . . -35.04 -49.81 0.47 Allowed 'General case' 0 N--CA 1.452 -0.355 1 N-CA-C 122.936 4.421 . . . . 0.0 122.936 -168.734 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -63.34 -40.01 96.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 124.85 1.344 . . . . 0.0 111.637 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -66.41 -46.02 77.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 130.431 3.492 . . . . 0.0 112.494 176.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.2 p -74.65 39.88 0.13 Allowed 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.549 3.14 . . . . 0.0 113.478 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -74.04 -26.41 60.4 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 129.12 2.968 . . . . 0.0 110.07 176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.0 -43.57 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 124.343 2.02 . . . . 0.0 112.897 -177.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -164.85 161.04 20.05 Favored 'General case' 0 N--CA 1.453 -0.324 2 C-N-CA 133.378 4.671 . . . . 0.0 111.885 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.336 2.6 p -142.12 -56.43 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 O-C-N 128.072 3.357 . . . . 0.0 104.555 -164.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -86.99 -9.37 55.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 124.381 3.264 . . . . 0.0 110.342 -168.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -94.28 -11.3 30.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.111 1.764 . . . . 0.0 106.448 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.4 mm -70.52 -15.49 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 1 O-C-N 115.762 -4.336 . . . . 0.0 111.974 175.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.251 71.8 mtm180 -75.09 -32.94 61.58 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 120.387 -1.445 . . . . 0.0 110.506 -176.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.75 -36.31 65.11 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 129.043 2.937 . . . . 0.0 105.151 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.57 HG22 HG23 ' B' ' 22' ' ' ILE . 23.6 t -74.8 -34.24 33.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 O-C-N 125.26 1.6 . . . . 0.0 111.649 176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.9 t -58.45 -37.94 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 O-C-N 119.021 -2.299 . . . . 0.0 114.319 164.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.6 m -74.73 -42.92 57.39 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.773 2.545 . . . . 0.0 108.0 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.411 18.4 p -39.95 -49.6 2.47 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 173.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HA ' ' CE1' ' B' ' 12' ' ' TYR . 33.8 mt -50.8 -52.83 37.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 130.168 3.387 . . . . 0.0 113.41 169.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -79.83 -27.56 40.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 116.649 -1.643 . . . . 0.0 112.364 -170.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.0 mttm -63.09 -34.07 76.8 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 124.583 1.177 . . . . 0.0 113.971 177.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.2 t -65.35 -38.74 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 128.651 2.78 . . . . 0.0 109.073 174.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.0 -40.85 99.0 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.609 2.004 . . . . 0.0 110.076 173.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.04 -31.94 73.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -174.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . 0.259 55.2 tttt -96.33 -37.13 10.62 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 118.477 -2.639 . . . . 0.0 112.459 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -77.53 -37.96 49.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 120.96 1.709 . . . . 0.0 109.213 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.04 -10.72 32.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 165.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.84 -38.94 10.08 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 116.744 -3.723 . . . . 0.0 112.809 172.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 p -71.45 -24.73 62.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.028 -3.545 . . . . 0.0 111.806 177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.0 m 102.88 79.34 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 131.626 3.97 . . . . 0.0 107.994 165.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.26 -171.87 12.43 Favored Glycine 0 C--N 1.344 0.987 0 CA-C-O 116.569 -2.239 . . . . 0.0 111.61 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -130.94 136.72 48.83 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 -177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 16.4 t -119.3 123.42 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -122.21 122.03 38.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.587 ' HB3' HD12 ' A' ' 53' ' ' ILE . 94.1 mt -115.64 112.21 21.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.926 3.291 . . . . 0.0 103.018 -172.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . 0.267 6.6 t80 -65.74 128.65 36.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 125.21 2.433 . . . . 0.0 109.866 -166.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.3 t70 82.77 -13.03 0.85 Allowed 'General case' 0 N--CA 1.448 -0.537 2 O-C-N 114.613 -5.054 . . . . 0.0 116.133 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.587 HD12 ' HB3' ' A' ' 50' ' ' LEU . 21.2 mt -103.06 -47.38 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.178 3.391 . . . . 0.0 106.474 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 116.98 -151.48 18.22 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 125.822 1.951 . . . . 0.0 115.299 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -135.59 133.71 38.58 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 119.147 -2.384 . . . . 0.0 114.513 -162.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -66.2 146.24 54.85 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.215 2.206 . . . . 0.0 110.216 153.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -146.3 159.73 42.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 119.36 0.982 . . . . 0.0 110.577 167.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.0 mp -95.1 135.59 36.47 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.192 0.597 . . . . 0.0 111.126 151.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 95.4 t -101.1 100.11 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.947 -2.242 . . . . 0.0 104.947 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.347 2.2 t -145.4 175.51 10.26 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.285 -175.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.0 p -123.97 173.74 8.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 127.221 2.208 . . . . 0.0 110.642 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.3 pttt -84.33 158.67 60.4 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 114.569 -2.634 . . . . 0.0 112.937 167.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.0 149.85 53.61 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 CA-C-N 124.281 2.564 . . . . 0.0 112.283 171.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.315 34.8 mtm105 -137.89 169.15 18.28 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.321 3.048 . . . . 0.0 110.564 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.345 2.8 t -151.76 148.32 27.74 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 126.543 1.937 . . . . 0.0 105.94 -178.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.31 -177.2 15.71 Favored Glycine 0 N--CA 1.447 -0.577 1 C-N-CA 132.409 4.814 . . . . 0.0 108.32 -175.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.267 1.5 pp -120.36 152.99 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 C-N-CA 126.125 1.77 . . . . 0.0 107.044 173.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.3 133.16 39.2 Favored Pre-proline 0 N--CA 1.439 -1.025 0 C-N-CA 130.256 3.423 . . . . 0.0 102.018 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.78 -17.86 5.82 Favored 'Trans proline' 0 N--CA 1.442 -1.508 0 N-CA-C 117.834 2.206 . . . . 0.0 117.834 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -93.02 -27.31 17.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.092 1.757 . . . . 0.0 112.523 -171.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 69.9 p -146.65 173.96 11.88 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 126.66 1.984 . . . . 0.0 107.823 176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -87.19 72.22 9.96 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 123.979 0.912 . . . . 0.0 108.621 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -126.99 166.45 17.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 131.325 3.85 . . . . 0.0 110.134 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -102.92 160.21 14.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.89 2.476 . . . . 0.0 113.12 164.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.6 mm -115.57 136.27 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 O-C-N 127.344 2.903 . . . . 0.0 103.526 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -98.19 134.81 40.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.612 . . . . 0.0 108.612 170.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.4 mt -125.31 101.12 31.64 Favored Pre-proline 0 N--CA 1.448 -0.558 0 N-CA-C 102.993 -2.965 . . . . 0.0 102.993 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -82.82 170.63 12.47 Favored 'Trans proline' 0 N--CA 1.451 -0.995 1 C-N-CA 127.333 5.356 . . . . 0.0 108.703 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -102.94 147.27 27.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 169.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.27 137.22 12.84 Favored Glycine 0 CA--C 1.528 0.85 1 C-N-CA 134.454 5.788 . . . . 0.0 113.379 170.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -125.91 145.97 50.04 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 125.45 1.324 . . . . 0.0 111.216 -171.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.7 pttt -143.6 144.94 32.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 126.963 2.665 . . . . 0.0 115.064 165.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 6.6 mt -102.58 127.95 55.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 -167.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.2 tttt -127.21 145.58 50.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.055 2.142 . . . . 0.0 108.334 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.8 tp -95.98 149.75 21.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.845 3.215 . . . . 0.0 104.89 168.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.5 p -138.72 98.66 3.61 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 102.76 -3.052 . . . . 0.0 102.76 173.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -83.57 132.62 31.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 125.768 2.699 . . . . 0.0 108.446 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 t -74.11 146.33 43.65 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.183 -2.823 . . . . 0.0 113.698 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.306 22.3 ptmt -46.93 -31.07 2.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 119.325 3.083 . . . . 0.0 119.325 -177.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.2 tt -76.67 5.6 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.5 tp -118.57 -9.92 10.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.48 1.912 . . . . 0.0 113.069 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.319 1.1 t -150.45 19.89 0.83 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 122.251 2.296 . . . . 0.0 114.938 -163.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -153.57 116.43 4.5 Favored 'General case' 0 C--O 1.223 -0.333 0 O-C-N 119.292 -2.13 . . . . 0.0 106.298 170.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.268 . . 65.5 15.08 9.86 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 129.185 2.994 . . . . 0.0 112.589 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.8 p -147.14 162.18 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 C-N-CA 130.929 3.692 . . . . 0.0 110.943 163.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.337 38.5 m-20 66.08 -99.5 0.06 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 112.929 -1.941 . . . . 0.0 113.756 158.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 80.1 p -89.88 -11.02 43.12 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 -171.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -152.82 98.62 2.35 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 101.649 -3.463 . . . . 0.0 101.649 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.7 pttt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 129.313 3.045 . . . . 0.0 109.137 173.784 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttt . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 135.61 38.8 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 129.494 3.118 . . . . 0.0 110.119 159.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -66.79 103.13 1.05 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 125.809 2.719 . . . . 0.0 110.209 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 pt -90.73 -176.67 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 118.556 -2.59 . . . . 0.0 113.818 162.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.255 63.7 tttt -30.96 -66.73 0.1 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 129.029 2.932 . . . . 0.0 114.741 -165.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 13.8 p -74.81 -31.06 61.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 124.661 2.172 . . . . 0.0 112.981 -168.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 86.3 mt -74.03 -36.25 64.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 119.596 -1.94 . . . . 0.0 111.176 178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 -39.39 83.85 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 117.451 -3.281 . . . . 0.0 111.091 166.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.75 -39.14 70.76 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 131.492 3.917 . . . . 0.0 112.987 -172.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.29 . . -105.33 9.66 33.77 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 118.675 -1.21 . . . . 0.0 111.387 -170.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -90.29 -29.75 17.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 34' ' ' LEU . 23.1 m-85 -66.23 -52.44 47.8 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.893 1.277 . . . . 0.0 110.796 -163.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 58.1 mt -70.44 5.0 1.97 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 116.659 2.096 . . . . 0.0 116.659 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -106.18 -41.72 5.27 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.453 -2.029 . . . . 0.0 107.962 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -80.97 -26.67 36.4 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 119.679 -1.888 . . . . 0.0 109.02 -170.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 18.7 ttt -169.52 121.66 0.72 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 128.406 2.683 . . . . 0.0 108.938 176.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.97 -17.72 2.74 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.122 2.139 . . . . 0.0 115.652 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.281 28.2 t70 62.72 38.36 11.95 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 129.011 2.925 . . . . 0.0 112.239 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 79.18 -72.84 0.07 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 130.577 3.551 . . . . 0.0 103.72 -173.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -160.93 15.09 0.11 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 128.442 2.697 . . . . 0.0 111.558 174.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -70.75 -12.9 61.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.57 HG23 HG22 ' A' ' 30' ' ' VAL . 21.7 mt -101.9 129.21 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 N-CA-C 102.793 -3.04 . . . . 0.0 102.793 160.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -121.89 169.3 10.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.521 1.928 . . . . 0.0 110.512 162.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 p -64.46 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 20.5 mp0 -63.77 -35.39 80.45 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 124.802 1.241 . . . . 0.0 111.805 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -68.69 -44.5 73.85 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 11.6 mt -61.42 -46.72 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 O-C-N 119.092 -2.255 . . . . 0.0 111.467 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.05 -8.41 5.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.383 1.473 . . . . 0.0 114.126 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 30.5 tp -88.74 -62.77 1.41 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 129.516 3.126 . . . . 0.0 107.508 168.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.2 t -55.59 -40.61 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -173.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -61.78 -11.64 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 C-N-CA 128.393 2.677 . . . . 0.0 115.797 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.419 6.0 t -138.84 47.35 1.94 Allowed 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 119.597 -1.939 . . . . 0.0 109.865 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 95.3 p -155.11 -52.03 0.09 Allowed 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 172.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.301 17.9 tp -31.55 -63.64 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 127.435 2.294 . . . . 0.0 116.37 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -48.57 -58.08 5.23 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 128.628 2.771 . . . . 0.0 115.487 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -65.22 -39.13 92.34 Favored 'General case' 0 N--CA 1.446 -0.659 1 C-N-CA 132.686 4.394 . . . . 0.0 109.614 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.09 -23.48 7.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 115.969 -1.967 . . . . 0.0 110.713 -174.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 66.1 mt -97.23 -2.7 42.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 117.517 2.414 . . . . 0.0 117.517 167.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.77 88.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 129.688 3.195 . . . . 0.0 106.919 -176.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -76.18 -8.56 57.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 121.081 3.734 . . . . 0.0 121.081 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.415 ' HG3' HD13 ' A' ' 7' ' ' LEU . 43.0 mm-40 -86.95 -38.96 16.17 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.29 2.869 . . . . 0.0 108.934 171.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.71 -25.38 66.5 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 120.767 -1.208 . . . . 0.0 111.792 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . 0.3 . . -84.77 5.62 27.76 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 127.967 2.507 . . . . 0.0 109.069 -176.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.381 14.8 t -126.25 10.75 7.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.114 2.166 . . . . 0.0 109.081 167.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.379 46.8 p 71.72 39.29 0.88 Allowed 'General case' 0 N--CA 1.448 -0.533 1 C-N-CA 132.031 4.132 . . . . 0.0 116.724 -178.174 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -93.28 129.91 10.09 Favored Glycine 0 N--CA 1.448 -0.557 0 O-C-N 117.918 -2.989 . . . . 0.0 107.622 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -76.09 118.35 18.75 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.8 t -92.96 103.89 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 117.215 -3.428 . . . . 0.0 106.474 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -94.99 121.81 36.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 116.932 -3.605 . . . . 0.0 105.683 175.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 56.3 mt -126.61 148.34 49.8 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 170.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -58.8 120.85 9.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 131.482 3.913 . . . . 0.0 115.16 -165.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.259 3.4 m-20 83.37 -33.46 0.08 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 125.912 2.008 . . . . 0.0 110.113 172.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.3 tp -87.1 -42.64 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 126.926 3.251 . . . . 0.0 115.206 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.66 -130.24 5.76 Favored Glycine 0 N--CA 1.448 -0.53 0 O-C-N 118.703 -2.498 . . . . 0.0 113.074 -173.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -147.0 155.81 42.54 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-O 123.969 1.842 . . . . 0.0 110.724 -178.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -126.92 139.37 53.11 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 100.248 -3.982 . . . . 0.0 100.248 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -155.16 155.43 33.93 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 113.958 -2.925 . . . . 0.0 111.339 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 9.1 tp -85.17 130.6 34.57 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 127.575 3.047 . . . . 0.0 110.744 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.294 48.8 t -133.17 136.5 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 1 N-CA-C 99.997 -4.075 . . . . 0.0 99.997 -169.274 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.8 p -90.18 150.84 21.83 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 120.776 -1.203 . . . . 0.0 111.974 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 64.9 m -98.23 137.01 37.61 Favored 'General case' 0 C--O 1.224 -0.262 1 N-CA-C 99.488 -4.264 . . . . 0.0 99.488 165.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -62.47 129.7 92.78 Favored Pre-proline 0 N--CA 1.449 -0.481 0 C-N-CA 129.357 3.063 . . . . 0.0 107.683 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -84.48 177.7 5.54 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 O-C-N 123.007 1.004 . . . . 0.0 114.512 -178.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 -124.26 166.16 16.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 128.856 2.862 . . . . 0.0 107.009 177.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.313 2.7 t -140.66 162.91 34.26 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.74 172.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -134.88 170.91 22.63 Favored Glycine 0 N--CA 1.443 -0.866 0 O-C-N 128.453 3.596 . . . . 0.0 106.946 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.92 146.92 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 C-N-CA 130.291 3.437 . . . . 0.0 105.46 165.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -82.86 133.78 48.13 Favored Pre-proline 0 C--N 1.329 -0.324 0 O-C-N 125.261 1.601 . . . . 0.0 107.032 177.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -84.23 -18.96 4.82 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 CA-C-N 123.757 2.377 . . . . 0.0 112.63 -176.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -87.19 -29.57 21.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.074 2.734 . . . . 0.0 108.502 -171.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.5 t -136.61 160.63 38.24 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 127.345 2.258 . . . . 0.0 111.408 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -79.26 78.36 5.75 Favored 'General case' 0 C--O 1.237 0.416 2 C-N-CA 131.878 4.071 . . . . 0.0 106.714 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -138.61 167.14 22.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 130.346 3.458 . . . . 0.0 111.728 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 83.9 mttt -114.25 159.5 20.09 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.09 -2.256 . . . . 0.0 110.353 -169.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -136.77 133.41 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.618 3.567 . . . . 0.0 101.496 -167.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . 0.25 67.4 mm-40 -106.94 137.57 44.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 169.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 85.1 mt -127.8 109.65 20.41 Favored Pre-proline 0 N--CA 1.446 -0.627 0 O-C-N 125.945 2.028 . . . . 0.0 108.337 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.38 146.99 25.24 Favored 'Trans proline' 0 N--CA 1.439 -1.693 0 C-N-CA 122.774 2.316 . . . . 0.0 106.959 177.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . 0.287 . . -103.68 -38.86 6.92 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 142.72 -174.96 23.27 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-O 124.456 2.142 . . . . 0.0 114.874 170.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -155.5 136.81 13.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.76 3.224 . . . . 0.0 114.732 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -152.83 161.14 42.93 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 128.135 2.574 . . . . 0.0 111.967 -168.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.78 136.24 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 126.622 1.969 . . . . 0.0 106.382 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -127.21 151.01 49.26 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 102.84 -3.022 . . . . 0.0 102.84 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 15.9 tp -98.28 143.36 28.86 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 128.901 2.881 . . . . 0.0 107.669 171.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.285 8.8 t -144.1 122.78 12.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 126.849 3.214 . . . . 0.0 107.471 171.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 19.8 m -81.0 155.61 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 110.075 -3.239 . . . . 0.0 115.172 -151.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 60.6 p -68.89 161.17 29.29 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 125.554 2.597 . . . . 0.0 115.208 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -44.35 -41.58 6.19 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.94 1.696 . . . . 0.0 114.468 164.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 mt -64.0 -33.98 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 126.538 1.935 . . . . 0.0 114.075 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 70.9 mt -89.12 -31.69 17.87 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.965 -2.335 . . . . 0.0 111.792 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 21.7 m -58.07 -30.03 65.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 168.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -68.62 -48.62 63.62 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 117.457 -1.259 . . . . 0.0 113.971 166.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.78 58.58 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.085 1.754 . . . . 0.0 114.344 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.35 -43.78 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 C-N-CA 129.716 3.206 . . . . 0.0 109.047 165.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -84.72 -43.74 14.02 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.259 -0.9 . . . . 0.0 109.911 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.2 136.19 3.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 121.053 -1.029 . . . . 0.0 112.691 151.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.4 t60 -65.24 125.65 25.68 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.518 3.056 . . . . 0.0 112.076 169.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? . . . . . 0 C--O 1.25 1.106 0 O-C-N 116.378 -3.951 . . . . 0.0 104.981 -175.013 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.9 ttp . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 117.3 -1.333 . . . . 0.0 111.575 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.43 146.47 26.95 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.46 1.027 . . . . 0.0 110.749 174.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -90.85 99.13 12.22 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.492 2.995 . . . . 0.0 104.375 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.4 mm -101.81 130.92 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.719 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -80.18 117.03 20.61 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 119.816 -1.803 . . . . 0.0 110.511 166.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p -78.9 116.72 19.4 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 109.242 -3.617 . . . . 0.0 107.558 169.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.63 160.72 39.21 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.896 2.135 . . . . 0.0 110.283 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.3 t -149.93 -136.37 0.07 Allowed 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.876 2.47 . . . . 0.0 112.751 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.16 -7.62 59.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -41.03 81.0 Favored 'General case' 0 N--CA 1.45 -0.474 1 O-C-N 116.189 -4.07 . . . . 0.0 113.229 173.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.6 -15.31 1.11 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 120.135 3.383 . . . . 0.0 120.135 173.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -104.08 -19.21 14.25 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 124.09 1.9 . . . . 0.0 109.719 -163.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 16.2 mt -65.47 -50.06 66.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 127.575 2.35 . . . . 0.0 109.114 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HE2' ' HB2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -83.25 -8.44 59.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 126.147 1.779 . . . . 0.0 113.56 -167.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -97.52 6.96 47.36 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.175 2.19 . . . . 0.0 108.533 167.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . 0.256 18.1 mmt -126.7 21.9 6.97 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 119.799 -1.813 . . . . 0.0 108.298 173.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.93 39.3 0.43 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 127.396 2.278 . . . . 0.0 113.094 -170.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -154.09 -50.93 0.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 128.842 2.857 . . . . 0.0 104.066 172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.43 -64.27 1.01 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 114.713 -2.565 . . . . 0.0 116.42 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.9 p -84.73 111.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 177.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -136.98 -8.31 1.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.705 -1.14 . . . . 0.0 111.424 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -82.85 -17.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 CA-C-N 121.981 2.173 . . . . 0.0 107.013 168.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.0 pttt -153.09 160.46 42.92 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.251 12.8 p -151.0 -37.58 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 CA-C-N 114.242 -1.344 . . . . 0.0 113.771 176.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . 0.298 4.6 tp-100 -72.24 -40.15 67.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 174.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -74.15 -9.66 58.84 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.925 1.69 . . . . 0.0 111.597 -177.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 27' ' ' ILE 0.255 39.2 mm -69.99 -26.23 29.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 124.258 1.98 . . . . 0.0 110.976 177.439 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -58.75 -29.19 66.56 Favored 'General case' 0 C--N 1.343 0.32 0 O-C-N 117.183 -3.448 . . . . 0.0 111.412 176.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 32.8 mt -82.11 -35.09 28.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.892 2.477 . . . . 0.0 110.015 -173.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -64.14 -39.53 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 128.192 2.597 . . . . 0.0 111.978 171.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.9 t -71.69 -24.75 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 C-N-CA 124.888 1.275 . . . . 0.0 111.115 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.414 HG23 ' CD2' ' B' ' 51' ' ' PHE . 29.9 m -77.87 -37.97 47.0 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 116.5 -1.714 . . . . 0.0 109.871 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.275 10.5 p -54.19 -45.84 72.28 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.827 2.528 . . . . 0.0 117.827 -176.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.79 -30.73 71.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 111.545 -2.571 . . . . 0.0 109.912 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -84.41 -43.59 14.53 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 122.158 2.254 . . . . 0.0 107.286 -170.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -52.48 -36.88 55.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 171.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG22 ' HG3' ' B' ' 11' ' ' GLU . 41.4 t -55.77 -52.99 42.46 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 C-N-CA 118.546 -1.262 . . . . 0.0 111.929 172.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 39.5 mt -59.06 -46.99 86.85 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.057 2.098 . . . . 0.0 111.841 -177.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.5 -49.32 78.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 125.243 1.417 . . . . 0.0 112.774 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 ttmt -64.5 -33.3 75.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 118.13 -0.938 . . . . 0.0 113.315 178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -71.98 -46.25 58.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 124.023 0.827 . . . . 0.0 109.505 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.3 mt -57.18 -42.08 80.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 129.477 3.111 . . . . 0.0 111.628 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.41 72.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 129.471 3.108 . . . . 0.0 111.802 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.4 p -75.26 -6.78 51.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 129.528 3.131 . . . . 0.0 115.906 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.328 64.1 m 70.86 67.93 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 128.573 2.749 . . . . 0.0 109.16 167.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -127.61 -137.51 4.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.439 2.447 . . . . 0.0 116.489 173.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -159.7 135.13 8.3 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 130.152 3.381 . . . . 0.0 115.577 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.3 t -114.15 127.17 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 165.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -110.43 96.38 6.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 124.655 2.169 . . . . 0.0 105.153 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD12 ' H ' ' A' ' 50' ' ' LEU 0.259 4.1 mp -89.1 137.24 32.49 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.124 1.916 . . . . 0.0 107.501 -178.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -86.31 116.95 24.8 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 118.435 -2.666 . . . . 0.0 109.998 -165.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.384 7.4 t70 91.0 -21.12 0.11 Allowed 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 127.248 2.843 . . . . 0.0 113.487 177.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.9 mt -85.82 -47.28 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 O-C-N 119.165 -2.209 . . . . 0.0 107.492 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.63 -150.28 20.25 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -128.46 146.79 50.7 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 122.837 1.303 . . . . 0.0 110.897 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -106.29 118.84 37.69 Favored 'General case' 0 N--CA 1.443 -0.808 1 C-N-CA 135.036 5.334 . . . . 0.0 106.656 167.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -151.98 173.68 14.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 127.412 2.285 . . . . 0.0 111.644 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.22 152.07 36.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.083 1.353 . . . . 0.0 113.227 161.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.0 t -108.59 139.79 29.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 N-CA-C 102.246 -3.242 . . . . 0.0 102.246 -178.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.386 10.3 t -150.0 139.28 21.31 Favored 'General case' 0 N--CA 1.443 -0.803 0 O-C-N 121.516 -0.74 . . . . 0.0 111.573 -173.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 69.1 p -97.08 141.24 30.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 126.848 2.059 . . . . 0.0 108.175 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -68.49 155.31 93.0 Favored Pre-proline 0 C--O 1.225 -0.225 0 CA-C-N 124.047 3.112 . . . . 0.0 112.107 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.01 159.23 30.66 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 116.916 -1.589 . . . . 0.0 111.547 174.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . 0.25 40.7 mtm105 -130.2 163.98 25.51 Favored 'General case' 0 N--CA 1.451 -0.407 1 O-C-N 132.179 5.924 . . . . 0.0 107.116 -177.54 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -149.96 145.77 26.65 Favored 'General case' 0 N--CA 1.449 -0.518 2 C-N-CA 134.408 5.083 . . . . 0.0 116.07 168.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -140.49 166.85 25.72 Favored Glycine 0 C--N 1.34 0.783 0 N-CA-C 104.63 -3.388 . . . . 0.0 104.63 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.2 pt -104.6 155.69 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 126.909 2.084 . . . . 0.0 110.962 167.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.88 132.0 37.74 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 103.111 -2.922 . . . . 0.0 103.111 -175.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.86 -20.55 22.29 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 CA-C-O 114.809 -2.246 . . . . 0.0 111.907 -174.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.22 -29.06 14.24 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 129.413 3.085 . . . . 0.0 112.965 -171.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.9 p -148.36 157.67 43.63 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.433 3.493 . . . . 0.0 113.347 -165.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -72.6 69.89 0.9 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 124.712 2.196 . . . . 0.0 113.307 172.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -133.08 108.87 9.12 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 119.144 -2.222 . . . . 0.0 107.96 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -92.05 133.47 35.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 26.2 mm -110.36 132.44 58.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 O-C-N 119.478 -2.014 . . . . 0.0 106.802 -172.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -105.52 130.34 53.61 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 130.24 3.416 . . . . 0.0 105.292 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 5.4 mt -116.8 99.09 52.7 Favored Pre-proline 0 N--CA 1.451 -0.405 0 C-N-CA 127.135 2.174 . . . . 0.0 108.045 170.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -84.18 172.36 9.63 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 CA-C-N 120.354 1.162 . . . . 0.0 114.061 -174.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.99 140.1 45.25 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 122.34 1.067 . . . . 0.0 113.473 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.68 142.04 16.27 Favored Glycine 0 C--N 1.336 0.576 0 C-N-CA 129.615 3.483 . . . . 0.0 110.148 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -137.15 139.88 41.47 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 115.335 -2.269 . . . . 0.0 109.648 -173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -148.43 143.17 26.59 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 116.587 -1.673 . . . . 0.0 110.935 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.44 HD12 HG11 ' B' ' 87' ' ' VAL . 27.8 mt -84.96 140.79 15.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 103.161 -2.903 . . . . 0.0 103.161 -171.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 tttt -143.89 133.96 24.2 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 119.713 -1.867 . . . . 0.0 107.007 171.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 tp -93.16 149.97 20.84 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 113.797 -1.547 . . . . 0.0 108.674 165.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.327 41.8 p -124.63 145.73 49.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.891 2.076 . . . . 0.0 108.839 162.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.34 131.34 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 128.028 2.531 . . . . 0.0 104.904 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.6 t -77.84 146.86 35.47 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.608 -2.087 . . . . 0.0 113.436 -177.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 89' ' ' LYS 0.386 37.4 mtpt -29.43 -62.08 0.13 Allowed 'General case' 0 N--CA 1.444 -0.751 1 C-N-CA 131.718 4.007 . . . . 0.0 120.502 -174.152 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 tp -60.93 -16.18 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 128.659 2.784 . . . . 0.0 113.256 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 11.5 tp -102.87 -12.82 17.27 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 125.312 2.482 . . . . 0.0 112.968 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.278 1.2 t -143.15 32.6 1.36 Allowed 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 118.35 -2.719 . . . . 0.0 114.556 -172.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -141.36 89.09 2.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 116.975 -3.578 . . . . 0.0 109.719 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . 0.348 . . 73.75 12.75 4.42 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 117.12 2.267 . . . . 0.0 117.12 -177.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 p -145.47 159.47 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-O 124.954 2.311 . . . . 0.0 105.318 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.262 4.3 m-20 67.27 -90.69 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.836 2.854 . . . . 0.0 111.473 163.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 92.2 p -89.96 -34.31 16.07 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.286 1.835 . . . . 0.0 110.78 -171.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . 0.252 4.7 t60 -126.69 92.91 3.64 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 129.384 3.074 . . . . 0.0 108.462 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.8 pttt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 129.222 3.009 . . . . 0.0 109.285 -179.672 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 123.814 1.768 . . . . 0.0 107.223 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.94 140.56 55.37 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.119 2.567 . . . . 0.0 107.847 159.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -88.68 98.78 11.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 116.622 -1.656 . . . . 0.0 106.827 -163.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 pt -74.75 160.72 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 125.174 1.546 . . . . 0.0 111.487 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.368 26.0 pttt -34.51 -45.83 0.25 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 170.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 16.7 p -75.27 -16.81 60.42 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 117.815 -3.053 . . . . 0.0 116.574 179.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . 0.317 14.1 mt -97.23 -26.28 14.98 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.027 2.131 . . . . 0.0 108.657 174.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.2 m -79.1 -35.42 42.32 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.567 -1.958 . . . . 0.0 113.118 169.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.5 -24.5 66.63 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -99.92 1.46 42.79 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.521 2.328 . . . . 0.0 114.308 171.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 37' ' ' VAL . 25.8 tp10 -99.01 -36.8 9.6 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.384 -1.77 . . . . 0.0 111.809 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -53.46 -46.31 69.85 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 125.302 3.683 . . . . 0.0 112.846 -170.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.9 mt -81.5 -25.28 36.12 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 116.041 -1.933 . . . . 0.0 111.516 -174.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -65.78 -47.51 74.9 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 130.1 3.36 . . . . 0.0 105.426 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . 0.269 29.2 tp10 -71.16 -59.38 2.81 Favored 'General case' 0 CA--C 1.516 -0.365 0 O-C-N 126.713 2.508 . . . . 0.0 114.681 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 13.4 ttt -142.2 107.58 5.03 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 117.645 -3.16 . . . . 0.0 107.542 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . 0.262 . . -118.42 -28.87 5.63 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 126.877 2.071 . . . . 0.0 111.642 161.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.28 23.7 t0 66.95 41.9 2.6 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.312 3.045 . . . . 0.0 113.731 -168.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 79.33 -62.89 0.28 Allowed 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.223 2.209 . . . . 0.0 115.985 -165.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -158.92 9.56 0.13 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 124.001 1.858 . . . . 0.0 113.115 -166.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -66.74 -59.72 3.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 103.149 -2.908 . . . . 0.0 103.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 27.8 mt -88.61 136.3 23.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 103.879 -2.638 . . . . 0.0 103.879 -175.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.25 152.49 29.74 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 128.516 2.727 . . . . 0.0 107.447 166.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.2 p -52.67 -21.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 117.158 2.281 . . . . 0.0 117.158 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -67.9 -45.58 74.04 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 128.962 2.905 . . . . 0.0 109.214 172.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.92 -48.16 80.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 123.883 0.74 . . . . 0.0 110.627 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . 0.27 52.2 mt -40.46 -59.55 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.789 3.235 . . . . 0.0 114.345 164.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -61.86 -0.85 0.53 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 119.781 3.252 . . . . 0.0 119.781 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 40.1 tp -101.28 -56.45 2.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 117.304 -1.759 . . . . 0.0 106.575 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . 0.369 10.9 t -41.89 -42.96 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.335 1 C-N-CA 132.689 4.396 . . . . 0.0 115.986 174.672 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.49 -7.19 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 O-C-N 116.787 -3.696 . . . . 0.0 115.598 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -119.76 14.9 12.63 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.19 2.268 . . . . 0.0 109.586 -173.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 90.5 p -144.35 -51.72 0.3 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.659 1.224 . . . . 0.0 114.115 -165.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -43.21 -49.48 6.57 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.158 2.183 . . . . 0.0 115.021 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 17.5 pm0 -72.5 -17.21 61.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 128.607 2.763 . . . . 0.0 114.83 -175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -73.76 -50.72 19.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.293 -2.129 . . . . 0.0 105.535 168.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.36 -33.14 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 C-N-CA 126.48 1.912 . . . . 0.0 114.203 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.78 -30.9 24.25 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 172.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.64 -55.27 17.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 119.568 -1.957 . . . . 0.0 114.832 168.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.242 1.817 . . . . 0.0 114.408 -176.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -81.02 -24.55 37.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 mt -77.75 -27.68 50.48 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.982 1.713 . . . . 0.0 109.21 171.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.18 -5.66 0.74 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 127.501 2.321 . . . . 0.0 113.318 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 13.9 t -123.98 -159.37 0.86 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 127.624 2.369 . . . . 0.0 110.768 170.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 75.85 10.21 Favored 'General case' 0 C--O 1.222 -0.394 0 O-C-N 117.6 -3.188 . . . . 0.0 111.158 169.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -119.31 121.3 4.93 Favored Glycine 0 C--N 1.338 0.647 1 N-CA-C 101.49 -4.644 . . . . 0.0 101.49 -177.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -99.4 100.47 11.53 Favored 'General case' 0 N--CA 1.449 -0.511 1 C-N-CA 132.06 4.144 . . . . 0.0 105.825 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.34 100.89 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -172.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 21.8 mtt180 -86.65 128.38 35.0 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 128.18 2.592 . . . . 0.0 106.506 170.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 17.5 mt -131.87 143.44 50.17 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 103.055 -2.943 . . . . 0.0 103.055 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . 0.414 ' CD2' HG23 ' A' ' 32' ' ' THR . 12.3 m-85 -69.64 132.04 45.56 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 128.068 2.547 . . . . 0.0 113.279 -167.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 79.96 -38.63 0.18 Allowed 'General case' 0 N--CA 1.441 -0.906 1 C-N-CA 132.996 4.518 . . . . 0.0 108.708 175.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.4 tp -73.62 -42.39 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 O-C-N 116.503 -3.873 . . . . 0.0 112.267 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 127.97 -127.95 5.89 Favored Glycine 0 N--CA 1.445 -0.721 0 O-C-N 119.879 -1.763 . . . . 0.0 109.756 170.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 pttt -140.08 139.25 35.83 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 126.376 2.989 . . . . 0.0 111.145 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . 0.404 ' CZ ' HD13 ' B' ' 85' ' ' LEU . 72.0 m-85 -100.65 152.82 19.99 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 129.991 3.316 . . . . 0.0 103.39 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . 0.343 54.4 pttt -164.01 147.0 9.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 129.732 3.213 . . . . 0.0 114.426 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -87.5 128.25 35.24 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.096 -1.411 . . . . 0.0 107.419 175.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.37 146.24 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 57.8 p -84.02 164.47 19.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.985 -2.322 . . . . 0.0 111.905 -172.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.4 m -107.61 136.95 46.5 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 124.618 2.151 . . . . 0.0 106.945 160.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -63.26 125.12 86.38 Favored Pre-proline 0 CA--C 1.514 -0.409 0 C-N-CA 129.864 3.266 . . . . 0.0 111.831 -176.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . 0.402 ' HB3' ' HA ' ' B' ' 78' ' ' PRO . 5.5 Cg_endo -61.33 164.2 15.65 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 O-C-N 125.861 2.506 . . . . 0.0 115.461 176.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -97.25 163.08 13.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 128.073 2.549 . . . . 0.0 110.857 156.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.388 12.9 t -149.14 138.14 21.35 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.068 3.347 . . . . 0.0 110.299 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -135.19 -176.66 14.47 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-O 117.005 -1.997 . . . . 0.0 113.731 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 46.3 mm -112.48 147.01 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.786 3.293 . . . . 0.0 107.294 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -72.96 133.17 82.12 Favored Pre-proline 0 N--CA 1.445 -0.684 0 C-N-CA 129.182 2.993 . . . . 0.0 109.318 169.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.73 -42.02 1.92 Allowed 'Trans proline' 0 N--CA 1.439 -1.7 0 O-C-N 124.825 1.961 . . . . 0.0 115.435 177.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -79.74 -18.77 50.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.873 3.269 . . . . 0.0 115.481 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 2.5 t -157.24 156.74 33.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.158 -1.383 . . . . 0.0 111.408 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -67.42 101.28 0.94 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 125.698 1.874 . . . . 0.0 107.126 170.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -172.03 138.72 1.04 Allowed 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.208 2.603 . . . . 0.0 113.497 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -92.41 138.91 31.11 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.551 1.167 . . . . 0.0 108.551 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 62.8 mt -94.81 145.53 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-O 113.601 -3.095 . . . . 0.0 108.818 166.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -119.76 126.96 52.3 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.783 2.552 . . . . 0.0 105.331 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 4.0 mt -127.68 121.5 22.18 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-N 121.868 2.122 . . . . 0.0 108.903 -174.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . 0.402 ' HA ' ' HB3' ' B' ' 63' ' ' PRO . 56.8 Cg_endo -84.0 172.91 9.46 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 CA-C-N 123.937 2.442 . . . . 0.0 115.553 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -134.75 14.59 3.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 118.569 2.803 . . . . 0.0 118.569 178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 98.6 -176.23 29.77 Favored Glycine 0 CA--C 1.525 0.71 0 O-C-N 119.045 -2.284 . . . . 0.0 117.85 167.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.2 mttt -134.58 144.58 48.02 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.247 1.819 . . . . 0.0 111.637 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.5 pttt -137.6 153.08 49.96 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 88.3 mt -76.7 133.58 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 C-N-CA 125.965 1.706 . . . . 0.0 108.582 158.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 42.3 mttt -115.4 152.74 32.31 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 102.777 -3.045 . . . . 0.0 102.777 161.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD13 ' CZ ' ' B' ' 56' ' ' PHE 0.379 9.9 tp -92.76 139.39 30.6 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.823 149.582 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 2.7 t -114.11 137.12 52.15 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.44 HG11 HD12 ' A' ' 83' ' ' ILE . 29.2 m -91.69 174.86 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 118.629 -2.544 . . . . 0.0 112.628 -148.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 8.6 p -87.71 167.21 14.06 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 128.517 2.727 . . . . 0.0 112.106 -178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.6 -40.71 97.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 129.863 3.265 . . . . 0.0 107.018 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.73 -44.48 93.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 112.616 -3.564 . . . . 0.0 112.833 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 65.5 mt -77.84 -24.17 48.73 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 127.73 3.144 . . . . 0.0 114.137 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.4 m -67.96 -37.05 81.09 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 116.526 2.047 . . . . 0.0 116.526 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -89.05 -31.27 18.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 125.826 1.954 . . . . 0.0 110.047 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.9 88.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 167.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.33 -24.29 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 1 O-C-N 116.233 -4.042 . . . . 0.0 116.467 168.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -72.69 -53.07 12.73 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.847 -1.069 . . . . 0.0 113.688 170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 12.2 t -169.21 113.67 0.55 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 175.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -81.94 116.94 21.8 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 124.857 2.265 . . . . 0.0 108.199 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . 0.331 0.1 OUTLIER . . . . . 0 C--O 1.247 0.951 0 CA-C-O 114.92 -2.467 . . . . 0.0 110.463 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 mtt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 125.82 2.724 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.42 163.06 12.54 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 125.303 2.477 . . . . 0.0 112.079 175.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -109.24 103.74 12.76 Favored 'General case' 0 N--CA 1.453 -0.29 1 O-C-N 115.629 -4.419 . . . . 0.0 102.39 169.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.7 mt -95.14 127.22 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 101.777 -3.416 . . . . 0.0 101.777 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -88.58 129.97 35.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 129.025 2.93 . . . . 0.0 103.241 -169.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 p -85.82 136.56 33.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 112.108 -2.314 . . . . 0.0 107.238 166.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -157.64 174.53 15.21 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 126.072 2.108 . . . . 0.0 107.37 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.4 t -169.24 -146.38 0.06 Allowed 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 102.596 -3.112 . . . . 0.0 102.596 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.21 -33.5 53.08 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 128.976 2.911 . . . . 0.0 117.073 -169.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.256 . . -50.0 -46.07 52.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 119.513 3.153 . . . . 0.0 119.513 171.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 7' ' ' LEU . 12.1 tp10 -65.13 -34.97 79.67 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 125.915 1.686 . . . . 0.0 107.553 -165.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -50.96 -59.98 3.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 128.719 2.807 . . . . 0.0 111.703 167.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.62 -25.28 68.03 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.605 1.962 . . . . 0.0 115.441 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . 0.274 25.2 tttt -73.79 -25.88 60.35 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 131.453 3.901 . . . . 0.0 110.977 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -96.54 -34.17 11.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 116.86 -1.543 . . . . 0.0 114.476 177.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 73.2 mmm -90.89 23.23 3.24 Favored 'General case' 0 N--CA 1.454 -0.259 0 O-C-N 128.276 3.485 . . . . 0.0 114.494 -173.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -43.75 -39.28 3.65 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.713 3.205 . . . . 0.0 116.656 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.81 -38.25 90.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 120.951 1.705 . . . . 0.0 111.01 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . 0.327 16.9 tp10 -104.63 -32.67 8.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 113.468 -3.158 . . . . 0.0 107.13 -160.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -117.32 104.83 11.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.726 2.512 . . . . 0.0 110.072 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -158.33 -40.59 0.06 Allowed 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 117.83 -1.081 . . . . 0.0 110.09 172.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -71.13 -39.57 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -120.68 118.94 31.41 Favored 'General case' 0 N--CA 1.457 -0.106 1 C-N-CA 133.587 4.755 . . . . 0.0 104.626 165.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . 0.333 3.6 p -142.15 -60.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 128.228 3.455 . . . . 0.0 112.771 -160.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -70.17 -34.21 72.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 112.215 -2.266 . . . . 0.0 112.962 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.18 -21.9 60.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.527 1.531 . . . . 0.0 111.369 -179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.9 mm -66.84 -29.23 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 1 CA-C-O 128.522 4.011 . . . . 0.0 112.0 -176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -64.63 -32.99 74.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 117.391 -3.318 . . . . 0.0 111.995 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.424 ' CB ' HD11 ' B' ' 22' ' ' ILE . 8.8 mt -64.11 -35.07 79.57 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 127.581 2.353 . . . . 0.0 114.389 174.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.0 t -76.76 -31.42 19.42 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 O-C-N 127.706 3.129 . . . . 0.0 107.005 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . 0.274 52.8 t -69.68 -42.63 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 122.049 0.928 . . . . 0.0 109.714 170.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.8 m -66.12 -33.62 76.19 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 129.191 2.996 . . . . 0.0 111.666 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -71.02 -12.81 61.73 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.79 -31.03 28.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.522 170.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -81.26 -38.24 27.21 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.932 1.693 . . . . 0.0 108.763 -169.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -69.36 -30.24 68.21 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 117.453 -1.26 . . . . 0.0 107.635 -170.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.23 -50.38 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-O 117.286 -1.34 . . . . 0.0 107.782 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 mt -49.99 -46.43 52.59 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.84 2.856 . . . . 0.0 118.373 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 -20.65 62.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 113.991 -2.909 . . . . 0.0 113.612 176.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -82.64 -43.93 16.37 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 127.891 3.244 . . . . 0.0 107.287 -168.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -64.1 -38.41 90.96 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 117.599 -3.188 . . . . 0.0 111.462 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.262 19.6 mt -59.69 -37.37 78.64 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.535 171.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.38 -35.8 58.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.8 p -81.05 -3.95 53.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 118.285 2.698 . . . . 0.0 118.285 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HD22 ' A' ' 58' ' ' LEU 0.316 98.9 m 79.99 55.4 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 117.682 -3.136 . . . . 0.0 114.685 173.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.33 -159.01 11.05 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-O 116.503 -2.276 . . . . 0.0 113.794 -175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -142.79 140.75 31.49 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 102.64 -3.096 . . . . 0.0 102.64 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.7 t -124.06 117.67 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . 0.354 92.4 mtt180 -101.59 131.81 47.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mt -90.52 151.71 21.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 113.079 -1.873 . . . . 0.0 108.56 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -66.59 123.12 19.19 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.679 1.228 . . . . 0.0 112.842 173.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.6 t70 69.78 -47.73 0.61 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.506 2.723 . . . . 0.0 116.504 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.0 mt -52.39 -41.61 35.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 1 C-N-CA 132.438 4.295 . . . . 0.0 113.339 -170.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.82 -154.62 17.61 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 126.526 2.012 . . . . 0.0 113.079 -168.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -135.14 148.55 49.77 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 117.692 2.478 . . . . 0.0 117.692 -169.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -98.7 123.49 42.94 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 115.212 -2.327 . . . . 0.0 106.994 168.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.299 3.0 pttt -143.41 175.47 9.9 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.716 2.006 . . . . 0.0 115.306 -175.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 HG23 ' A' ' 45' ' ' THR . 5.0 mp -118.52 139.58 51.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 126.825 3.202 . . . . 0.0 111.815 170.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 55.3 t -80.18 111.32 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 1 C-N-CA 133.782 4.833 . . . . 0.0 106.625 158.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 t -142.72 134.5 26.81 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 124.096 3.134 . . . . 0.0 112.513 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.2 p -107.53 128.17 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 127.472 2.309 . . . . 0.0 106.588 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.6 pttt -72.82 163.27 69.48 Favored Pre-proline 0 N--CA 1.45 -0.465 0 C-N-CA 125.854 1.662 . . . . 0.0 112.948 168.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.39 170.82 16.42 Favored 'Trans proline' 0 N--CA 1.442 -1.523 1 C-N-CA 125.618 4.212 . . . . 0.0 118.183 175.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 59.6 mtm180 -153.39 169.68 22.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.673 2.789 . . . . 0.0 113.632 -170.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . 0.281 3.6 t -138.91 138.44 37.38 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 125.041 1.463 . . . . 0.0 110.788 163.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -113.69 160.54 13.09 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 106.044 -2.822 . . . . 0.0 106.044 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -97.48 159.63 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 124.924 2.297 . . . . 0.0 108.666 170.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -77.4 133.32 67.9 Favored Pre-proline 0 N--CA 1.443 -0.823 1 C-N-CA 136.583 5.953 . . . . 0.0 107.066 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -84.14 -18.34 5.21 Favored 'Trans proline' 0 N--CA 1.447 -1.264 0 C-N-CA 125.294 3.996 . . . . 0.0 117.599 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -96.8 -34.0 11.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.644 1.578 . . . . 0.0 110.003 -173.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.5 p -135.41 175.56 9.48 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 122.062 2.21 . . . . 0.0 107.862 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -76.22 68.94 2.7 Favored 'General case' 0 N--CA 1.451 -0.423 1 O-C-N 114.542 -5.098 . . . . 0.0 111.812 159.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -128.36 -174.78 3.32 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 117.529 -3.232 . . . . 0.0 107.78 170.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -149.49 156.91 42.75 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.083 -172.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.452 HD12 ' N ' ' A' ' 75' ' ' ILE . 4.5 mp -115.96 128.4 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 116.757 -1.592 . . . . 0.0 107.781 178.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -85.2 123.88 31.21 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.299 -2.286 . . . . 0.0 105.037 169.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 85.4 mt -102.72 122.17 46.91 Favored Pre-proline 0 N--CA 1.447 -0.596 0 N-CA-C 103.313 -2.847 . . . . 0.0 103.313 -174.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.44 165.26 20.92 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-O 125.256 2.107 . . . . 0.0 111.439 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.58 150.86 42.74 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 109.113 -3.676 . . . . 0.0 110.337 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -113.5 161.92 12.54 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 129.283 3.325 . . . . 0.0 106.161 176.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -168.34 131.4 1.49 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -157.78 147.51 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.143 -2.848 . . . . 0.0 111.199 163.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 39.4 mt -79.18 152.34 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 O-C-N 125.485 1.741 . . . . 0.0 111.655 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.307 68.1 tttt -152.3 116.46 4.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.054 1.742 . . . . 0.0 113.999 -172.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.68 127.82 34.61 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.005 -2.961 . . . . 0.0 103.005 173.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 23.6 p -123.99 89.1 3.03 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 123.708 1.718 . . . . 0.0 108.764 168.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.21 135.5 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 O-C-N 116.986 -3.571 . . . . 0.0 110.049 162.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.6 t -65.89 129.85 41.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.733 2.813 . . . . 0.0 105.134 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -47.96 -23.61 0.83 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.83 2.052 . . . . 0.0 116.153 -169.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -59.04 -33.57 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.837 1.655 . . . . 0.0 112.6 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.49 -1.2 45.12 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 125.145 1.528 . . . . 0.0 111.303 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.383 4.4 t -142.88 24.36 1.85 Allowed 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 126.991 2.116 . . . . 0.0 112.984 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -147.01 109.29 4.5 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 115.439 -4.538 . . . . 0.0 109.13 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 78.01 -4.74 2.19 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.186 2.995 . . . . 0.0 112.272 165.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.345 2.5 p -151.92 168.84 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 127.923 2.489 . . . . 0.0 113.004 176.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.341 12.3 m-20 72.56 -58.8 0.58 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 131.202 3.801 . . . . 0.0 110.98 161.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.326 97.3 p -122.59 -22.71 5.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 122.339 2.336 . . . . 0.0 114.193 -179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -162.87 124.74 2.59 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 -158.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.2 pttt . . . . . 0 C--O 1.257 1.475 0 C-N-CA 128.004 2.522 . . . . 0.0 109.642 170.467 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttp . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 104.297 -2.483 . . . . 0.0 104.297 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.58 131.21 45.19 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 127.978 2.511 . . . . 0.0 112.792 167.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . 0.254 23.5 mmtp -98.51 111.31 23.71 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -162.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 3.6 pt -100.36 170.48 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.53 -1.356 . . . . 0.0 110.272 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.392 0.0 OUTLIER -52.24 -39.69 60.64 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 126.721 2.513 . . . . 0.0 112.431 -156.341 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -64.39 -31.37 72.55 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.979 2.112 . . . . 0.0 116.233 176.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -95.47 -20.65 18.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 128.473 3.608 . . . . 0.0 110.282 -173.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -75.18 -37.61 61.16 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 114.894 -2.479 . . . . 0.0 108.279 163.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . 0.272 . . -50.53 -38.11 42.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 128.805 2.842 . . . . 0.0 112.845 -172.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.2 -40.53 23.72 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 128.14 3.4 . . . . 0.0 116.445 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -53.68 -36.43 62.16 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 130.175 3.39 . . . . 0.0 118.104 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -57.04 -52.11 66.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.826 -1.797 . . . . 0.0 111.156 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.7 -21.53 63.49 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.147 1.379 . . . . 0.0 114.069 175.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -77.12 -37.49 54.01 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 120.317 -1.489 . . . . 0.0 110.141 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -89.93 -19.39 24.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.638 2.375 . . . . 0.0 116.727 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 12.5 ttt -175.37 96.33 0.07 Allowed 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 118.202 -2.811 . . . . 0.0 108.901 -167.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.12 -24.49 10.71 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.185 -1.825 . . . . 0.0 111.442 162.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.496 15.6 t0 76.63 35.6 0.4 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 128.852 2.861 . . . . 0.0 111.336 -170.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 86.44 -71.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 1 C-N-CA 132.661 4.384 . . . . 0.0 104.623 -165.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.278 14.0 t -158.16 40.52 0.26 Allowed 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 125.58 1.8 . . . . 0.0 111.211 -173.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -84.6 -61.87 1.69 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.122 -1.611 . . . . 0.0 106.873 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.424 HD11 ' CB ' ' A' ' 29' ' ' LEU . 24.1 mt -74.57 132.71 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 C-N-CA 124.895 1.278 . . . . 0.0 109.242 -174.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -129.41 155.85 45.01 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 129.751 3.22 . . . . 0.0 109.885 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -57.63 -18.61 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 122.618 1.199 . . . . 0.0 113.799 -168.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -74.57 -34.11 62.83 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . 0.31 83.8 m-20 -75.19 -38.35 60.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 130.679 3.592 . . . . 0.0 109.029 -174.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 6.0 mm -60.67 -48.75 87.34 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 118.932 -2.355 . . . . 0.0 109.76 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -69.94 -17.3 63.31 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.464 1.106 . . . . 0.0 113.712 -174.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 38.7 tp -79.82 -35.5 38.32 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 163.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -81.72 -31.49 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 126.62 2.45 . . . . 0.0 113.191 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -85.28 0.51 5.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 114.478 -2.677 . . . . 0.0 110.908 -170.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -105.16 -14.42 15.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 128.12 2.568 . . . . 0.0 108.901 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 96.1 p -119.36 -37.24 3.2 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -168.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 66.2 tp -45.34 -68.4 0.2 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 128.731 2.812 . . . . 0.0 113.381 -167.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -60.73 -22.14 63.69 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 130.496 3.518 . . . . 0.0 112.809 176.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -85.59 -23.84 27.42 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 116.621 -1.657 . . . . 0.0 111.642 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.66 -35.93 8.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-N 122.334 2.333 . . . . 0.0 108.599 -176.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.23 -13.7 40.35 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 128.468 2.707 . . . . 0.0 116.0 -177.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.7 -39.0 57.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 127.144 2.177 . . . . 0.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -80.02 -6.16 57.08 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -95.99 -27.25 15.22 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 120.542 -1.349 . . . . 0.0 110.464 173.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 18.2 mt -74.28 -12.69 60.62 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.134 2.174 . . . . 0.0 110.978 172.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -97.97 9.3 43.12 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.328 1.061 . . . . 0.0 111.756 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 10.1 t -148.72 -169.44 3.36 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 172.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.259 45.2 p -70.6 63.82 0.28 Allowed 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 117.084 -3.51 . . . . 0.0 111.064 -174.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.47 122.05 5.96 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.998 2.237 . . . . 0.0 108.33 175.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -114.81 109.45 18.18 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 167.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.92 121.57 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 120.751 -1.218 . . . . 0.0 111.182 -172.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -93.49 146.0 24.1 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.282 2.233 . . . . 0.0 106.938 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 1.3 tp -149.24 150.39 32.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -172.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.68 115.95 5.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 130.147 3.379 . . . . 0.0 110.795 -166.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.487 2.1 m-20 80.71 -40.99 0.17 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 130.592 3.557 . . . . 0.0 113.806 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 12.4 tt -77.38 -31.43 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 112.766 -2.015 . . . . 0.0 113.601 -168.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 123.36 -127.18 6.51 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-O 116.052 -2.527 . . . . 0.0 111.284 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.281 49.9 pttt -144.65 151.43 38.97 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 123.106 1.431 . . . . 0.0 107.907 -169.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -126.49 139.39 53.27 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 128.042 2.537 . . . . 0.0 111.029 -172.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -146.42 154.56 41.76 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.593 1.957 . . . . 0.0 108.686 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.62 126.99 39.09 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 172.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.6 m -120.57 164.92 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 O-C-N 126.775 2.547 . . . . 0.0 107.999 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 33.8 p -87.7 154.12 20.83 Favored 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 126.039 2.087 . . . . 0.0 107.852 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 15.3 m -98.06 153.98 18.04 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.304 -3.134 . . . . 0.0 103.286 161.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -60.24 123.15 71.65 Favored Pre-proline 0 N--CA 1.447 -0.577 0 C-N-CA 126.097 1.759 . . . . 0.0 109.145 176.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.74 159.88 49.58 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 CA-C-N 123.542 2.301 . . . . 0.0 115.287 168.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -103.83 166.28 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.108 3.763 . . . . 0.0 115.26 172.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . 0.259 9.2 t -141.81 143.08 33.24 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 125.457 2.551 . . . . 0.0 107.918 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -121.51 -176.69 15.34 Favored Glycine 0 CA--C 1.527 0.838 0 CA-C-N 110.835 -2.893 . . . . 0.0 112.378 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 15.2 mm -129.06 132.67 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.53 131.6 94.88 Favored Pre-proline 0 N--CA 1.449 -0.517 0 O-C-N 116.908 -3.62 . . . . 0.0 114.761 156.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -82.96 -7.84 11.15 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 N-CA-C 121.341 3.554 . . . . 0.0 121.341 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -92.39 -23.46 19.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 116.782 -1.58 . . . . 0.0 112.321 -170.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 8.9 t -149.72 141.36 23.52 Favored 'General case' 0 N--CA 1.444 -0.743 1 N-CA-C 98.683 -4.562 . . . . 0.0 98.683 164.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -77.32 85.14 3.75 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pt20 -131.9 142.81 49.77 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 126.5 1.92 . . . . 0.0 110.445 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -85.17 125.82 33.14 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.36 2.264 . . . . 0.0 111.235 -163.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mt -84.04 157.69 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 125.929 1.692 . . . . 0.0 106.466 171.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -122.39 130.03 52.69 Favored 'General case' 0 N--CA 1.445 -0.687 1 N-CA-C 99.021 -4.437 . . . . 0.0 99.021 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.7 mt -135.68 123.05 14.82 Favored Pre-proline 0 N--CA 1.445 -0.711 1 O-C-N 129.9 4.5 . . . . 0.0 104.692 -169.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.86 167.0 28.42 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 121.075 1.183 . . . . 0.0 113.403 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -142.33 -19.36 0.7 Allowed 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 129.827 3.251 . . . . 0.0 113.29 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.75 -159.63 18.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-O 124.006 1.892 . . . . 0.0 113.913 158.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -133.5 -179.19 5.37 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 111.591 -2.305 . . . . 0.0 107.594 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 32.6 pttt -170.46 136.35 1.3 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 130.61 3.564 . . . . 0.0 109.506 -163.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . 0.267 39.5 mt -89.32 129.5 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 174.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -117.47 126.12 52.07 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 129.458 3.103 . . . . 0.0 106.211 -172.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . 0.308 21.4 tp -80.93 153.11 27.71 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 126.862 2.065 . . . . 0.0 106.872 165.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.342 6.2 t -140.39 135.49 32.14 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 125.455 2.55 . . . . 0.0 106.452 163.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 32.1 m -96.02 150.41 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 112.578 -2.101 . . . . 0.0 112.664 -158.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 81.0 p -61.23 171.18 1.42 Allowed 'General case' 0 N--CA 1.445 -0.703 0 O-C-N 125.896 1.997 . . . . 0.0 114.307 -171.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -60.45 -23.39 64.4 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 122.075 2.216 . . . . 0.0 114.032 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 4.4 mt -72.9 -59.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.135 1.774 . . . . 0.0 109.576 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' B' ' 91' ' ' LEU . 32.2 mt -58.67 -30.7 67.57 Favored 'General case' 0 N--CA 1.444 -0.739 0 O-C-N 126.525 2.391 . . . . 0.0 112.224 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 54.1 m -67.55 -42.26 82.95 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.547 1.539 . . . . 0.0 111.121 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -67.68 -48.91 65.28 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.973 1.709 . . . . 0.0 111.38 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.47 -47.52 48.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.643 2.377 . . . . 0.0 117.351 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 19.5 t -71.31 -39.19 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 111.896 -2.411 . . . . 0.0 115.361 172.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . 0.276 36.5 t70 -58.52 -58.82 6.86 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 120.366 -1.459 . . . . 0.0 114.778 167.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 26.0 t -131.66 107.01 8.52 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.556 2.435 . . . . 0.0 106.487 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 37.0 t60 -87.3 140.93 29.04 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 126.285 2.945 . . . . 0.0 104.079 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.374 0 O-C-N 116.753 -3.717 . . . . 0.0 112.092 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ttt . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 111.909 -3.9 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.77 84.27 0.89 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 101.483 -3.525 . . . . 0.0 101.483 169.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -83.75 65.62 8.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 126.427 1.891 . . . . 0.0 105.936 171.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.258 80.3 mt -129.51 131.09 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 102.175 -3.268 . . . . 0.0 102.175 -161.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -79.5 136.29 36.86 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 125.579 2.609 . . . . 0.0 109.925 -178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.9 p -100.56 123.06 44.26 Favored 'General case' 0 N--CA 1.454 -0.255 1 CA-C-N 107.737 -4.301 . . . . 0.0 108.08 170.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.92 153.99 51.27 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.239 -1.8 . . . . 0.0 107.531 -172.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.6 t -151.33 -153.76 0.51 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.682 2.393 . . . . 0.0 107.011 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.07 -21.31 3.08 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.389 3.876 . . . . 0.0 118.478 -176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.83 -36.35 50.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 112.95 -1.932 . . . . 0.0 108.844 -178.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -33.61 71.11 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 117.333 -3.354 . . . . 0.0 110.815 175.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -57.87 -67.18 0.36 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.898 -2.001 . . . . 0.0 112.985 174.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.7 mt -75.31 -17.85 60.17 Favored 'General case' 0 C--N 1.346 0.419 0 O-C-N 125.661 1.85 . . . . 0.0 107.847 -152.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.27 -29.77 70.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 123.308 2.776 . . . . 0.0 113.077 169.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -80.55 -26.12 38.2 Favored 'General case' 0 C--O 1.223 -0.321 0 O-C-N 117.412 -3.305 . . . . 0.0 111.291 166.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.4 mmm -87.31 17.33 4.47 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 116.705 -3.747 . . . . 0.0 110.813 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.32 -20.17 65.56 Favored 'General case' 0 N--CA 1.446 -0.629 1 O-C-N 114.861 -4.899 . . . . 0.0 111.303 -173.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.82 -35.72 62.43 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 121.212 1.824 . . . . 0.0 112.791 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -89.49 -47.88 7.69 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.53 1.932 . . . . 0.0 113.18 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.4 p -122.36 99.59 6.5 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 126.251 2.219 . . . . 0.0 107.933 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -133.67 -24.28 1.76 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 123.526 2.876 . . . . 0.0 112.799 174.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.53 -34.63 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 115.251 -2.309 . . . . 0.0 105.346 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -111.14 125.24 53.58 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 120.589 1.541 . . . . 0.0 107.647 165.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.33 -40.68 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 118.189 -1.404 . . . . 0.0 112.049 -172.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -80.64 -18.47 48.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.857 1.208 . . . . 0.0 110.574 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -88.49 -22.35 23.69 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 129.006 2.923 . . . . 0.0 108.362 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.485 ' O ' HG23 ' A' ' 31' ' ' VAL . 37.0 mm -78.47 -18.69 13.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -58.18 -29.57 65.73 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 120.13 -1.606 . . . . 0.0 114.054 159.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.6 mt -80.16 -22.66 41.77 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 125.083 1.49 . . . . 0.0 109.008 -175.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.418 HG22 HG12 ' B' ' 22' ' ' ILE . 9.2 t -80.04 -38.02 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 123.073 1.416 . . . . 0.0 107.779 -177.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 27' ' ' ILE . 54.0 t -65.42 -31.92 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 127.43 2.292 . . . . 0.0 106.817 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -79.31 -43.41 23.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.457 1.503 . . . . 0.0 108.269 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 t -58.9 -33.55 70.66 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 129.49 3.116 . . . . 0.0 110.862 -173.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.56 -49.99 55.27 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 120.464 -1.397 . . . . 0.0 107.631 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -71.17 -27.17 63.34 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 127.55 3.031 . . . . 0.0 111.086 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -53.88 -54.33 40.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.384 2.673 . . . . 0.0 113.493 170.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 4.8 t -67.89 -50.48 59.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 125.11 1.364 . . . . 0.0 108.111 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 7.7 mt -40.93 -64.94 0.48 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 117.654 -3.154 . . . . 0.0 116.344 173.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.77 -51.19 52.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 113.016 -1.902 . . . . 0.0 111.527 170.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -71.58 -33.29 68.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 117.287 -3.383 . . . . 0.0 115.719 -172.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -61.75 -38.0 86.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.84 2.257 . . . . 0.0 113.689 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.414 HD21 ' HB3' ' A' ' 56' ' ' PHE . 36.3 mt -67.82 -46.01 73.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 116.963 -3.586 . . . . 0.0 112.89 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -16.28 42.39 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 117.807 2.521 . . . . 0.0 117.807 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.8 p -108.04 1.98 22.81 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.045 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.296 24.2 m 84.6 48.94 0.01 OUTLIER 'General case' 0 C--O 1.237 0.414 0 CA-C-O 125.531 2.586 . . . . 0.0 109.651 163.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -110.74 -155.37 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 128.849 3.119 . . . . 0.0 116.282 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -147.7 133.39 18.89 Favored 'General case' 0 N--CA 1.444 -0.728 1 C-N-CA 132.766 4.426 . . . . 0.0 111.39 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.9 t -116.63 139.06 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 170.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -129.93 98.65 4.84 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.675 -171.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.76 147.24 25.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 127.354 2.909 . . . . 0.0 106.467 -173.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -68.16 104.6 1.84 Allowed 'General case' 0 N--CA 1.448 -0.551 1 C-N-CA 132.458 4.303 . . . . 0.0 113.766 -168.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 74.98 -28.42 0.19 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 128.187 3.43 . . . . 0.0 114.811 -169.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . 0.298 79.3 mt -65.59 -36.65 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 131.426 3.891 . . . . 0.0 112.568 -169.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 107.79 -147.48 16.44 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 129.243 3.306 . . . . 0.0 107.003 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . 0.258 17.5 ptpt -133.36 140.63 47.49 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 111.571 -2.314 . . . . 0.0 115.26 -160.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.414 ' HB3' HD21 ' A' ' 42' ' ' LEU 0.266 37.6 m-85 -96.54 136.58 36.85 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.884 1.674 . . . . 0.0 106.838 156.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -159.34 -173.21 4.07 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 116.939 -1.505 . . . . 0.0 107.618 -174.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.42 151.63 36.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 124.8 3.455 . . . . 0.0 108.693 168.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.07 130.82 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 160.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.2 t -153.06 140.95 20.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.087 2.117 . . . . 0.0 108.055 -158.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.5 p -122.37 138.73 54.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 129.598 3.159 . . . . 0.0 109.115 166.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.9 pttt -88.81 154.41 50.19 Favored Pre-proline 0 N--CA 1.45 -0.431 0 C-N-CA 127.591 2.356 . . . . 0.0 111.938 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . 0.323 50.9 Cg_endo -66.93 164.71 28.71 Favored 'Trans proline' 0 N--CA 1.443 -1.455 0 N-CA-C 119.766 2.948 . . . . 0.0 119.766 -170.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -130.17 136.28 49.08 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 127.674 2.39 . . . . 0.0 110.144 175.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.2 t -141.3 -174.23 3.97 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 125.46 -147.39 16.56 Favored Glycine 0 C--N 1.337 0.597 0 O-C-N 118.855 -2.403 . . . . 0.0 111.629 178.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.2 pt -132.27 140.33 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.54 128.69 88.61 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-O 114.836 -2.507 . . . . 0.0 109.799 163.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -74.16 -28.06 11.14 Favored 'Trans proline' 0 N--CA 1.444 -1.408 0 O-C-N 127.191 3.206 . . . . 0.0 116.79 -175.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -94.0 -30.46 14.71 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.222 3.009 . . . . 0.0 108.086 -166.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.7 p -143.28 159.71 41.84 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 125.596 1.81 . . . . 0.0 109.186 -177.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -69.84 91.75 0.66 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 126.349 1.86 . . . . 0.0 112.964 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -159.41 131.87 6.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.78 2.832 . . . . 0.0 107.625 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -43.79 141.63 1.51 Allowed 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 117.65 2.463 . . . . 0.0 117.65 157.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.3 mt -105.15 132.65 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 100.873 -3.751 . . . . 0.0 100.873 161.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -147.98 77.58 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 -178.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.4 mt -92.96 127.57 46.95 Favored Pre-proline 0 CA--C 1.513 -0.453 0 N-CA-C 102.915 -2.995 . . . . 0.0 102.915 172.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -87.23 172.02 6.28 Favored 'Trans proline' 0 N--CA 1.447 -1.225 0 O-C-N 125.414 2.27 . . . . 0.0 109.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -53.69 151.15 6.41 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 128.516 2.726 . . . . 0.0 111.304 171.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -139.78 124.47 2.72 Favored Glycine 0 C--N 1.337 0.593 0 CA-C-O 114.828 -3.207 . . . . 0.0 115.326 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -147.24 153.05 39.32 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -177.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . 0.254 16.4 ptpt -140.7 147.53 39.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 127.28 2.232 . . . . 0.0 112.411 165.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mt -68.61 140.87 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 C-N-CA 128.072 2.549 . . . . 0.0 111.327 169.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -140.0 158.2 44.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.742 1.617 . . . . 0.0 112.654 169.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.3 tp -121.45 128.99 52.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.314 1.445 . . . . 0.0 107.364 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . 0.255 2.6 p -134.96 69.33 1.45 Allowed 'General case' 0 N--CA 1.442 -0.843 0 O-C-N 125.337 1.648 . . . . 0.0 107.499 -173.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.302 2.5 t -81.94 156.42 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 -177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.479 ' OG ' HG22 ' A' ' 90' ' ' ILE . 9.1 t -63.25 141.08 58.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 128.254 2.622 . . . . 0.0 111.092 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -53.83 -25.99 22.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 126.834 2.054 . . . . 0.0 114.989 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.479 HG22 ' OG ' ' A' ' 88' ' ' SER 0.265 6.5 tt -65.69 -1.1 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 118.416 2.747 . . . . 0.0 118.416 -170.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.1 mp -112.8 11.26 19.29 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.942 -3.599 . . . . 0.0 106.782 172.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.276 10.9 t -157.41 22.11 0.29 Allowed 'General case' 0 N--CA 1.45 -0.439 1 O-C-N 115.893 -4.254 . . . . 0.0 109.136 -167.331 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -148.19 116.17 6.43 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.89 2.876 . . . . 0.0 108.75 -175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 74.22 -25.82 0.2 Allowed 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.973 2.046 . . . . 0.0 114.805 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.6 p -152.7 162.07 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 113.778 -3.01 . . . . 0.0 111.015 -166.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . 0.352 67.9 m-20 84.98 -68.04 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 131.038 3.735 . . . . 0.0 108.851 152.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . 0.33 24.3 p -127.35 7.46 6.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.418 -2.676 . . . . 0.0 116.672 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.6 t60 -161.58 147.26 13.77 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 127.117 2.167 . . . . 0.0 107.771 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.8 pttt . . . . . 0 C--O 1.247 0.949 0 O-C-N 119.07 -2.268 . . . . 0.0 108.564 -163.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tpt . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 113.244 -3.265 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.83 111.78 0.9 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 121.522 1.964 . . . . 0.0 111.544 171.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -60.85 94.98 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.045 2.138 . . . . 0.0 114.341 -162.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.4 pt -75.07 155.03 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 1 C-N-CA 132.15 4.18 . . . . 0.0 108.604 165.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . 0.283 13.6 tmtt? -28.55 -53.72 0.11 Allowed 'General case' 0 C--O 1.22 -0.476 1 C-N-CA 133.836 4.854 . . . . 0.0 116.033 -177.458 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 9.6 p -76.08 -24.62 55.07 Favored 'General case' 0 N--CA 1.445 -0.723 0 O-C-N 119.466 -2.021 . . . . 0.0 110.763 -165.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 83.4 mt -81.09 -44.62 17.69 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.3 m -64.02 -34.35 77.8 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 117.357 2.354 . . . . 0.0 117.357 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 25.56 0.12 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 127.115 2.166 . . . . 0.0 115.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.317 . . -142.09 5.17 1.69 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 130.464 3.506 . . . . 0.0 113.061 166.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -103.26 -32.08 9.77 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 117.239 -3.413 . . . . 0.0 113.64 -175.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -67.02 -60.7 2.41 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 129.323 3.049 . . . . 0.0 106.546 -169.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -77.69 15.73 0.78 Allowed 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.896 2.078 . . . . 0.0 112.341 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -109.12 -43.21 4.22 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 124.985 1.314 . . . . 0.0 108.116 171.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.122 0.969 . . . . 0.0 110.46 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 14.8 ttt -160.93 102.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 128.406 2.683 . . . . 0.0 104.854 177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -98.17 -38.5 9.29 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 118.216 2.672 . . . . 0.0 118.216 165.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . 0.515 26.9 t70 78.04 51.68 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.7 1.6 . . . . 0.0 110.971 -169.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 72.77 -96.75 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -163.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . 0.288 5.9 t -142.45 34.9 1.47 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.013 2.925 . . . . 0.0 116.27 172.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -66.57 -47.06 73.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 118.181 -2.825 . . . . 0.0 109.739 176.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 30' ' ' VAL . 35.1 mt -93.15 128.95 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-N 110.69 -2.959 . . . . 0.0 107.229 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -130.75 170.2 14.68 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 131.079 3.752 . . . . 0.0 105.351 -176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 29.5 m -57.2 -35.16 47.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 O-C-N 116.764 -3.71 . . . . 0.0 116.941 172.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . 0.362 6.0 mp0 -39.0 -55.55 1.54 Allowed 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.718 2.007 . . . . 0.0 116.207 161.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.08 -45.59 33.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.253 1.421 . . . . 0.0 109.516 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 5.4 mm -50.1 -47.58 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 O-C-N 120.328 -1.482 . . . . 0.0 110.167 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -75.1 -10.14 59.19 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.875 -1.536 . . . . 0.0 111.807 -171.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 31.4 tp -88.29 -47.8 8.14 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 109.022 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 58.4 t -64.99 -38.43 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-O 113.288 -3.244 . . . . 0.0 110.2 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.42 8.79 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 121.861 2.119 . . . . 0.0 112.139 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . 0.387 4.4 t -129.0 2.84 5.28 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 118.778 -2.452 . . . . 0.0 110.823 179.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.35 89.6 p -125.83 -20.16 4.69 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.15 -63.74 1.25 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.157 2.183 . . . . 0.0 108.379 -160.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.9 pm0 -55.02 -21.49 12.29 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 117.901 2.556 . . . . 0.0 117.901 166.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -79.59 -40.78 28.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 117.783 -1.104 . . . . 0.0 110.395 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 46.3 t -76.35 -35.58 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.692 1.597 . . . . 0.0 112.466 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 mt -81.34 -8.16 59.69 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 115.078 -2.392 . . . . 0.0 108.771 -172.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.48 77.38 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 122.041 2.2 . . . . 0.0 113.885 -168.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 38.7 pttt -58.66 -32.38 69.05 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 112.801 -1.999 . . . . 0.0 115.621 171.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 44' ' ' THR . 58.4 mm-40 -91.58 -17.52 25.48 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 117.637 -1.173 . . . . 0.0 112.415 -177.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -77.72 -33.95 52.86 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 125.841 1.963 . . . . 0.0 113.342 169.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -18.86 60.37 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 128.109 2.564 . . . . 0.0 113.98 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . 0.425 HG22 ' HA ' ' B' ' 41' ' ' GLU 0.29 7.1 t -118.36 -162.8 0.91 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.07 2.106 . . . . 0.0 105.553 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . 0.272 34.5 p -64.57 42.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -117.38 143.72 18.03 Favored Glycine 0 C--N 1.339 0.707 0 O-C-N 117.564 -3.21 . . . . 0.0 108.517 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -122.76 103.64 8.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.217 2.207 . . . . 0.0 106.522 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.49 110.83 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 -170.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -80.27 144.59 32.73 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 165.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -138.59 140.31 38.94 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 104.317 -2.475 . . . . 0.0 104.317 174.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -59.22 130.6 47.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.316 1.846 . . . . 0.0 113.758 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.372 7.9 m-20 81.44 -55.3 0.28 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 130.035 3.334 . . . . 0.0 115.943 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 tp -73.81 -19.45 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-N 112.948 -1.933 . . . . 0.0 113.0 -166.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 108.76 -129.01 9.32 Favored Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 125.962 1.744 . . . . 0.0 110.634 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . 0.317 24.3 pttt -136.97 148.31 46.84 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -104.67 133.12 50.05 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 127.175 2.19 . . . . 0.0 106.6 -174.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 53.9 pttt -130.27 157.64 41.97 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 tp -94.86 119.66 33.79 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 129.426 3.091 . . . . 0.0 113.692 171.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 17.9 m -126.83 145.47 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 O-C-N 116.37 -3.956 . . . . 0.0 112.936 -171.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 72.4 p -80.01 137.52 36.83 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 120.908 1.685 . . . . 0.0 107.044 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.446 HG23 ' HE3' ' B' ' 82' ' ' LYS . 6.6 m -89.55 137.34 32.42 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 117.095 -3.503 . . . . 0.0 108.188 -178.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -44.05 125.06 4.31 Favored Pre-proline 0 N--CA 1.445 -0.683 0 C-N-CA 128.938 2.895 . . . . 0.0 110.757 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -55.48 141.16 83.04 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 C-N-CA 123.667 2.911 . . . . 0.0 116.964 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -85.69 167.32 15.4 Favored 'General case' 0 N--CA 1.451 -0.383 1 O-C-N 129.411 4.195 . . . . 0.0 105.538 166.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 10.1 t -132.5 137.48 47.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 124.16 1.933 . . . . 0.0 113.972 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . -117.49 -171.21 15.47 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 113.119 -1.855 . . . . 0.0 112.179 169.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 21.4 mm -110.41 137.12 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 102.509 -3.145 . . . . 0.0 102.509 161.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -50.49 129.72 25.94 Favored Pre-proline 0 N--CA 1.444 -0.774 0 C-N-CA 131.218 3.807 . . . . 0.0 112.167 167.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.8 -34.13 50.93 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 124.931 3.754 . . . . 0.0 121.061 174.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -90.71 -21.99 21.33 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.126 2.87 . . . . 0.0 115.553 -167.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 9.2 t -157.71 157.13 32.9 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 118.881 -2.387 . . . . 0.0 107.218 -170.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -82.61 83.37 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 117.738 -3.101 . . . . 0.0 110.285 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -138.76 156.48 47.33 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.991 2.516 . . . . 0.0 109.313 -174.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -81.67 143.25 32.02 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 114.875 -2.488 . . . . 0.0 111.538 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 2.1 mt -98.88 137.42 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 127.188 2.195 . . . . 0.0 106.753 165.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -98.99 101.19 12.49 Favored 'General case' 0 C--N 1.324 -0.538 1 C-N-CA 133.07 4.548 . . . . 0.0 109.336 154.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 25.9 mt -100.88 122.92 47.28 Favored Pre-proline 0 CA--C 1.515 -0.389 0 C-N-CA 127.349 2.26 . . . . 0.0 106.323 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -70.27 151.95 66.4 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.799 2.333 . . . . 0.0 112.826 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -121.62 -5.13 9.23 Favored 'General case' 0 CA--C 1.513 -0.452 0 O-C-N 126.342 2.277 . . . . 0.0 111.838 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . 136.18 -165.07 25.01 Favored Glycine 0 C--N 1.341 0.841 0 C-N-CA 126.973 2.225 . . . . 0.0 113.584 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -137.1 136.65 38.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 111.857 -2.171 . . . . 0.0 110.559 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.446 ' HE3' HG23 ' B' ' 61' ' ' THR . 14.6 ptpt -117.16 147.76 42.17 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 129.44 3.096 . . . . 0.0 113.244 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.03 124.04 39.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 164.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -116.46 123.81 48.41 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.309 3.044 . . . . 0.0 105.107 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 18.5 tp -85.27 154.03 22.21 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 167.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . 0.397 3.3 t -136.5 119.64 16.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 101.889 -3.375 . . . . 0.0 101.889 164.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 27.6 m -83.97 166.18 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 C-N-CA 128.372 2.669 . . . . 0.0 113.949 -177.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.253 88.6 p -61.45 174.96 0.65 Allowed 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.891 2.076 . . . . 0.0 111.59 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -62.41 -32.29 73.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 120.326 -1.483 . . . . 0.0 113.932 160.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 mt -66.66 -46.48 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 118.214 -2.804 . . . . 0.0 110.663 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 85.7 mt -80.04 8.53 6.93 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.868 -3.02 . . . . 0.0 115.393 173.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 -69.49 0.76 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 104.909 -2.256 . . . . 0.0 104.909 159.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -43.5 -61.39 1.39 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 131.108 3.763 . . . . 0.0 115.606 -172.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.77 15.09 10.33 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 127.216 2.206 . . . . 0.0 112.703 -173.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . 0.39 54.4 t -107.87 -44.35 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 127.777 3.656 . . . . 0.0 114.086 157.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -64.53 -19.65 65.74 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 131.048 3.739 . . . . 0.0 115.351 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' SER . . . . . . . . . . . . . 90.8 p -137.77 148.76 45.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.16 2.184 . . . . 0.0 107.023 167.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' HIS . . . . . . . . . . . . . 28.0 t60 -76.77 100.81 5.59 Favored 'General case' 0 N--CA 1.44 -0.959 0 O-C-N 124.898 1.374 . . . . 0.0 110.952 -170.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 82.5 mttt . . . . . 0 C--O 1.251 1.145 0 O-C-N 119.356 -2.09 . . . . 0.0 111.139 -170.737 . . . . . . . . 0 0 . 1 stop_ save_