data_2ktf_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 2ktf _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.2 mm . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 . . . . . 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 mm . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 46.7 m0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.6 mm . . . . . 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 44.7 m0 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 4.9 mm . . . . . 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 50.4 m0 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.45 HG22 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.45 ' CH2' HG22 ' B' ' 683' ' ' ILE . 47.1 m0 . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.41 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.408 HG23 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.408 ' CH2' HG23 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.7 mm . . . . . 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . 0.425 ' C ' ' H ' ' B' ' 691' ' ' LEU . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.435 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.435 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 . . . . . 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.458 HG22 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.458 ' CH2' HG22 ' B' ' 683' ' ' ILE . 45.8 m0 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 mm . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 38.0 m0 . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.1 mm . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 37.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.401 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.441 HG23 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.441 ' CH2' HG23 ' B' ' 683' ' ' ILE . 42.6 m0 . . . . . 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.2 mm . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 34.6 m0 . . . . . 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.457 HG23 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm . . . . . 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.457 ' CH2' HG23 ' B' ' 683' ' ' ILE . 53.8 m0 . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.406 HG23 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm . . . . . 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.406 ' CH2' HG23 ' B' ' 683' ' ' ILE . 52.9 m0 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 mm . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 38.8 m0 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 . . . . . 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 3.5 mm . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . 0.42 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . 0.42 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 50.3 m0 . . . . . 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . 0.448 HG22 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . 0.448 ' CH2' HG22 ' B' ' 683' ' ' ILE . 41.4 m0 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 3.0 mm . . . . . 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 48.2 m0 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.6 mm . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 47.8 m0 . . . . . 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.5 24.83 8.47 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 70.2 -57.24 0.57 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.96 1.704 . . . . 0.0 113.507 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -161.64 -178.29 6.46 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 120.03 1.287 . . . . 0.0 110.853 -169.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -165.19 -46.27 0.02 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 169.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 174.309 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 111.669 -0.572 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -134.63 12.65 3.74 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.339 1.056 . . . . 0.0 112.468 -171.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -160.67 167.87 26.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.814 1.246 . . . . 0.0 109.215 177.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -142.97 -75.94 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 116.471 -1.728 . . . . 0.0 107.815 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.46 168.3 24.04 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 122.376 1.884 . . . . 0.0 109.211 169.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -59.53 -17.04 28.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.177 0.991 . . . . 0.0 112.691 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -66.61 -0.1 2.64 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.119 1.368 . . . . 0.0 114.288 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.2 mm -130.08 143.35 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 120.101 1.319 . . . . 0.0 110.023 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 -60.35 -46.89 88.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -42.44 98.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 125.064 1.345 . . . . 0.0 110.775 175.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -66.32 -49.7 66.12 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.692 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.4 p -73.27 -26.34 61.05 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 118.769 0.713 . . . . 0.0 110.488 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 128.091 2.757 . . . . 0.0 112.651 177.113 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -109.77 17.78 20.87 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 mp 65.7 -43.8 0.37 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.504 1.922 . . . . 0.0 115.337 172.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 ptt85 -158.55 172.56 18.08 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.619 1.554 . . . . 0.0 110.472 -169.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.1 34.87 1.89 Allowed Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.292 0.949 . . . . 0.0 110.988 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.507 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.47 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 112.347 -0.301 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.66 21.5 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 111.518 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.08 172.93 17.31 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.679 1.592 . . . . 0.0 108.506 -178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.257 51.6 t80 49.28 60.21 15.85 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.958 0.903 . . . . 0.0 110.494 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -65.19 -175.46 0.4 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 123.908 3.072 . . . . 0.0 111.115 170.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -52.93 -14.65 0.6 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.952 1.701 . . . . 0.0 113.64 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -57.45 -14.77 5.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.652 1.181 . . . . 0.0 112.372 169.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 mm -136.88 152.17 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -57.76 -47.6 82.04 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -78.8 -27.68 44.48 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.636 -0.665 . . . . 0.0 112.698 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 -72.34 -46.83 53.83 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.069 0.85 . . . . 0.0 110.486 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.6 m -82.98 -37.99 23.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 124.932 1.293 . . . . 0.0 109.269 -169.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.297 -1.28 . . . . 0.0 110.591 -177.032 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -108.28 24.76 12.53 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . 0.284 0.0 OUTLIER 46.46 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 168.044 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -143.85 148.67 35.82 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 124.074 3.125 . . . . 0.0 110.739 174.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -89.83 65.8 2.92 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 169.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 -177.736 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 CA-C-O 121.361 0.423 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -140.66 163.5 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.454 1.502 . . . . 0.0 108.941 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.5 mmt -68.28 158.67 32.89 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.014 0.526 . . . . 0.0 109.839 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 89.5 t80 46.36 57.26 16.74 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.697 0.799 . . . . 0.0 111.221 -169.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' B' ' 682' ' ' ASP . 41.5 Cg_endo -72.71 -172.34 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.563 2.842 . . . . 0.0 110.391 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.8 m -60.4 11.72 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.94 2.096 . . . . 0.0 114.465 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' B' ' 680' ' ' PRO . 30.2 t70 -84.63 -3.58 58.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.282 1.833 . . . . 0.0 112.444 169.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.6 mm -135.73 142.35 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -170.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 44.7 m0 -60.6 -49.98 75.35 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -31.53 66.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.423 -0.799 . . . . 0.0 112.328 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.1 mtm180 -67.78 -50.03 59.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.832 1.196 . . . . 0.0 111.181 176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.1 p -83.55 -21.18 32.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.658 0.383 . . . . 0.0 111.517 -171.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 126.245 1.879 . . . . 0.0 111.958 174.672 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.5 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.5 14.51 11.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.5 ' H ' ' HG ' ' A' ' 71' ' ' LEU . 3.3 mp 68.19 -59.52 0.44 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.2 1.8 . . . . 0.0 113.698 171.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -169.15 166.96 10.67 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.205 1.402 . . . . 0.0 110.609 -171.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -145.73 19.52 1.82 Allowed Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.103 1.335 . . . . 0.0 111.635 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.278 0 C-N-CA 126.992 2.234 . . . . 0.0 107.782 175.467 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.998 0.221 . . . . 0.0 112.643 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -71.49 -31.59 67.28 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 122.144 -0.621 . . . . 0.0 111.537 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 42.8 ttp -80.89 144.02 32.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 169.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.33 0.1 OUTLIER 36.66 53.33 2.46 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.821 2.048 . . . . 0.0 115.273 178.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -61.01 -176.67 0.16 Allowed 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.17 2.58 . . . . 0.0 109.47 169.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -49.2 -23.07 1.17 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.585 1.154 . . . . 0.0 113.963 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.6 -20.55 8.22 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.332 1.853 . . . . 0.0 115.238 171.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 4.9 mm -133.8 140.93 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -173.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 50.4 m0 -60.24 -36.58 78.09 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -86.83 -28.42 22.92 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.0 mtp85 -63.4 -45.76 89.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.07 0.85 . . . . 0.0 111.049 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 26.3 p -69.75 -51.78 31.17 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.327 0 C-N-CA 126.096 1.808 . . . . 0.0 111.17 178.636 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.504 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.7 23.71 5.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.504 ' H ' ' HG ' ' A' ' 71' ' ' LEU . 1.4 mm? 70.38 -56.66 0.59 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.173 1.789 . . . . 0.0 113.618 169.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -162.66 160.34 25.52 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 120.291 1.405 . . . . 0.0 111.385 -172.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.66 31.79 1.76 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.071 1.319 . . . . 0.0 110.474 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.028 0 C-N-CA 127.348 2.404 . . . . 0.0 107.522 178.251 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.489 -0.645 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -133.54 169.96 16.22 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.945 1.298 . . . . 0.0 109.847 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -61.43 156.91 18.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.5 1.12 . . . . 0.0 110.887 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 93.3 t80 46.17 58.42 16.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 124.202 1.001 . . . . 0.0 111.229 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.61 -172.66 0.98 Allowed 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.213 2.609 . . . . 0.0 110.318 171.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -55.63 -14.69 2.31 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.218 1.407 . . . . 0.0 113.625 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -57.64 -7.31 0.64 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.916 1.687 . . . . 0.0 114.773 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.45 HG22 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -133.19 137.95 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 -174.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.45 ' CH2' HG22 ' B' ' 683' ' ' ILE . 47.1 m0 -62.29 -48.53 79.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.54 -29.72 61.49 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.677 -0.678 . . . . 0.0 112.577 178.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -66.03 -53.27 40.72 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.258 0.936 . . . . 0.0 110.597 176.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.9 p -81.01 -25.47 37.2 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 123.172 0.295 . . . . 0.0 110.82 -170.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 C-N-CA 126.273 1.892 . . . . 0.0 112.393 172.831 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.41 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -109.68 15.01 23.11 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.2 mp 65.44 -50.05 0.37 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.985 1.714 . . . . 0.0 114.753 174.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -164.52 154.66 14.26 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.34 1.456 . . . . 0.0 109.403 -169.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.1 -26.45 73.78 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.581 0.628 . . . . 0.0 111.867 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.287 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 177.972 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 CA-C-O 120.96 0.2 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -68.92 -23.88 64.22 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.869 0.868 . . . . 0.0 113.06 -175.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.6 mmt -134.21 170.68 15.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.484 1.513 . . . . 0.0 109.378 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 48.14 57.44 17.98 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 111.423 -169.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -72.01 -172.92 0.93 Allowed 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 123.247 2.632 . . . . 0.0 110.516 170.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.7 m -55.88 -14.04 2.19 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.286 1.434 . . . . 0.0 113.948 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.43 -6.41 0.68 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.006 1.722 . . . . 0.0 114.805 170.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.408 HG23 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm -132.76 137.77 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -175.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.408 ' CH2' HG23 ' B' ' 683' ' ' ILE . 49.6 m0 -60.78 -48.25 82.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -76.46 -32.31 58.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.611 -0.68 . . . . 0.0 112.336 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.26 -48.86 74.15 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.741 0.701 . . . . 0.0 110.431 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.7 p -78.7 -30.13 45.86 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.277 0.361 . . . . 0.0 110.957 -178.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.322 0 C-N-CA 126.985 2.231 . . . . 0.0 112.45 -177.769 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.458 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.26 21.2 3.72 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 mm? 59.47 -22.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 120.42 3.489 . . . . 0.0 120.42 168.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.03 171.4 6.89 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 121.48 1.946 . . . . 0.0 111.025 -175.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 174.48 -21.25 0.06 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.7 -0.625 . . . . 0.0 113.152 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 177.221 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.873 0 CA-C-O 121.26 0.367 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -69.86 -20.8 63.39 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -143.24 160.09 41.12 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.984 0.913 . . . . 0.0 109.671 177.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.327 0.3 OUTLIER 50.77 63.84 9.21 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 124.224 1.009 . . . . 0.0 111.485 -178.152 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.53 -171.54 0.96 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.139 1.893 . . . . 0.0 107.43 168.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -58.89 4.49 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 115.367 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -84.45 -15.15 47.12 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.745 1.618 . . . . 0.0 113.571 170.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.7 mm -132.8 159.05 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -170.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . 0.425 ' C ' ' H ' ' B' ' 691' ' ' LEU . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 -60.87 -53.76 53.34 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -72.45 -30.9 64.99 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.6 mtp85 -63.92 -50.64 67.92 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 118.658 0.663 . . . . 0.0 110.533 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 30.9 p -69.83 -42.62 73.38 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.393 0 C-N-CA 126.234 1.873 . . . . 0.0 113.12 171.393 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -115.28 15.58 16.91 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 mp 63.37 -20.24 0.06 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 118.559 2.8 . . . . 0.0 118.559 170.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -65.15 169.68 5.31 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.461 1.937 . . . . 0.0 110.457 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.08 -27.35 0.18 Allowed Glycine 0 CA--C 1.532 1.13 0 O-C-N 121.473 -0.767 . . . . 0.0 112.313 172.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 C-N-CA 125.663 1.602 . . . . 0.0 109.398 178.547 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 CA-C-O 121.168 0.315 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -68.14 159.57 30.75 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 122.079 -0.659 . . . . 0.0 110.781 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -68.43 161.81 26.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.28 1.032 . . . . 0.0 110.158 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.3 t80 47.73 59.19 16.98 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.772 0.829 . . . . 0.0 110.927 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.36 -173.39 0.94 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.03 2.487 . . . . 0.0 110.419 169.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.5 m -56.23 -13.25 1.98 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.242 1.417 . . . . 0.0 114.032 172.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.57 -5.08 0.49 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.139 1.776 . . . . 0.0 114.809 171.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.435 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm -134.58 140.03 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -173.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.435 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 -59.32 -49.06 79.28 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -74.04 -28.62 61.5 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.465 -0.772 . . . . 0.0 112.565 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -72.87 -45.08 60.21 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.948 0.795 . . . . 0.0 110.116 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 32.9 m -87.52 -22.03 25.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.349 -169.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.303 0 C-N-CA 126.966 2.222 . . . . 0.0 112.758 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.77 21.5 11.95 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 70.71 -63.55 0.41 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.895 1.278 . . . . 0.0 112.31 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -173.46 165.57 4.67 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 110.813 -169.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -93.61 -19.88 33.5 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.445 -0.642 . . . . 0.0 111.887 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 178.767 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -139.21 -27.39 0.81 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.64 1.576 . . . . 0.0 110.698 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.7 mmt -78.67 164.12 24.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.858 0.754 . . . . 0.0 110.167 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 47.54 57.39 17.75 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.098 0.959 . . . . 0.0 110.963 -169.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -71.24 -173.36 0.91 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.391 2.727 . . . . 0.0 110.522 169.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.4 m -55.76 -12.94 1.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.614 1.566 . . . . 0.0 113.931 172.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -59.1 -4.08 0.46 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.125 1.77 . . . . 0.0 114.546 171.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.458 HG22 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm -135.92 139.06 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -172.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.458 ' CH2' HG22 ' B' ' 683' ' ' ILE . 45.8 m0 -62.1 -45.78 92.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -77.37 -31.31 54.2 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.417 0.553 . . . . 0.0 112.418 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 9.5 mtp85 -62.24 -51.1 69.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.886 0.766 . . . . 0.0 110.694 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 27.2 p -72.13 -50.1 30.67 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.34 0 C-N-CA 125.439 1.495 . . . . 0.0 110.834 170.482 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.36 18.55 14.37 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 69.31 -57.25 0.53 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.223 1.409 . . . . 0.0 113.422 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -164.8 158.85 17.91 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 120.243 1.383 . . . . 0.0 110.414 -169.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -137.83 3.16 3.12 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.659 1.123 . . . . 0.0 112.282 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.446 0 N-CA-C 108.816 -1.714 . . . . 0.0 108.816 176.907 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -141.48 163.94 31.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.763 1.225 . . . . 0.0 109.887 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 56.9 mtt -68.39 162.77 24.66 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.29 -92.95 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 169.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -71.84 161.6 44.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 CA-C-N 123.561 2.308 . . . . 0.0 108.043 168.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -62.39 -9.8 9.4 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.127 0.971 . . . . 0.0 112.951 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.09 -4.86 14.92 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.061 175.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 mm -131.02 146.56 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 119.378 0.99 . . . . 0.0 109.256 -169.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.07 -47.44 86.33 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -75.72 -26.51 57.56 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -74.02 -48.1 32.43 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.163 0.892 . . . . 0.0 109.817 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 33.2 m -79.95 -36.91 35.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.62 1.168 . . . . 0.0 109.187 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.126 -1.375 . . . . 0.0 110.619 -175.15 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.03 21.06 9.87 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.9 mm? 65.49 -33.43 0.17 Allowed 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 117.331 2.345 . . . . 0.0 117.331 169.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.7 167.48 7.31 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.637 1.108 . . . . 0.0 111.902 -169.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -172.09 40.41 0.17 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.172 0 N-CA-C 109.091 -1.603 . . . . 0.0 109.091 -174.015 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.096 0 CA-C-O 119.983 -0.343 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -73.84 0.31 13.63 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.315 1.057 . . . . 0.0 113.67 -176.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.66 158.3 44.04 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.094 1.758 . . . . 0.0 107.264 173.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -135.96 -78.62 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 116.548 -1.691 . . . . 0.0 108.0 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -72.99 167.03 28.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 122.254 1.841 . . . . 0.0 109.001 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.0 m -59.65 -17.18 31.8 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.146 0.978 . . . . 0.0 112.755 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -70.63 1.06 5.71 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.056 1.743 . . . . 0.0 114.469 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.1 mm -131.36 146.47 33.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 119.927 1.24 . . . . 0.0 109.337 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -61.0 -50.14 74.6 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -69.39 -31.79 70.4 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.171 0.441 . . . . 0.0 111.84 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -74.14 -33.26 63.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.258 0.481 . . . . 0.0 111.386 -174.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 24.0 m -103.2 -19.42 14.51 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.687 1.595 . . . . 0.0 109.935 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.304 0 C-N-CA 126.911 2.196 . . . . 0.0 111.782 172.228 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.401 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.35 20.79 11.87 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 63.75 -33.91 0.14 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 169.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -67.52 169.52 9.06 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.754 1.615 . . . . 0.0 111.213 -169.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.32 42.35 0.27 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.243 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -174.913 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.814 -0.514 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -133.13 20.37 4.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 111.702 -170.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -123.32 141.32 52.11 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 -177.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.6 t80 47.25 54.25 15.13 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 123.799 0.839 . . . . 0.0 110.669 -168.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . 0.437 ' C ' ' H ' ' B' ' 682' ' ' ASP . 32.5 Cg_endo -74.61 -169.77 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.301 2.668 . . . . 0.0 110.245 176.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -60.88 15.83 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.26 2.224 . . . . 0.0 114.136 169.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . 0.437 ' H ' ' C ' ' B' ' 680' ' ' PRO . 34.8 t70 -94.36 -0.98 54.53 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.756 1.622 . . . . 0.0 111.841 169.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.441 HG23 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm -135.71 143.18 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -174.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.441 ' CH2' HG23 ' B' ' 683' ' ' ILE . 42.6 m0 -60.4 -46.84 88.57 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 54.4 pttt -79.18 -25.89 42.72 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -72.24 -45.33 60.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.271 0.941 . . . . 0.0 109.164 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.7 m -80.48 -31.27 37.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.326 -170.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.214 0 C-N-CA 126.069 1.795 . . . . 0.0 111.931 172.83 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? -121.89 25.27 9.24 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 66.47 -52.69 0.43 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 169.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt85 -157.39 168.45 27.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 120.887 1.676 . . . . 0.0 112.165 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.37 -37.0 54.53 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 123.71 0.671 . . . . 0.0 112.747 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.0 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -177.885 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -60.85 152.89 26.04 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.79 0.836 . . . . 0.0 111.254 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.12 156.55 17.9 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.702 0.801 . . . . 0.0 111.588 170.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 3.7 t80 42.12 63.42 6.8 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 125.345 1.458 . . . . 0.0 111.202 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . 0.478 ' C ' ' H ' ' B' ' 682' ' ' ASP . 60.3 Cg_endo -71.58 -171.36 0.63 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.191 1.927 . . . . 0.0 108.988 169.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -60.43 17.01 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.452 1.901 . . . . 0.0 114.108 169.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . 0.478 ' H ' ' C ' ' B' ' 680' ' ' PRO . 31.3 t70 -95.3 -7.7 38.0 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 127.152 2.181 . . . . 0.0 112.356 171.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 1.2 mm -133.46 147.45 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -173.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -62.07 -49.82 74.43 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -72.28 -24.09 61.29 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.171 0.896 . . . . 0.0 112.59 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -66.55 -49.84 65.14 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.386 0.994 . . . . 0.0 110.626 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 29.7 p -71.24 -39.56 71.58 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.609 1.095 . . . . 0.0 109.305 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.332 0 C-N-CA 126.875 2.179 . . . . 0.0 111.51 175.677 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -113.16 17.66 18.53 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 mp 64.48 -44.98 0.31 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 172.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -157.76 178.64 10.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.92 1.691 . . . . 0.0 111.254 -169.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.12 44.28 2.6 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.697 1.141 . . . . 0.0 113.105 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.238 0 N-CA-C 108.043 -2.023 . . . . 0.0 108.043 -176.106 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.947 0 CA-C-O 121.657 0.587 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -65.13 155.4 34.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.699 0.8 . . . . 0.0 110.825 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.1 mmt -68.1 158.15 33.7 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 84.4 t80 48.68 57.48 18.2 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 123.377 0.671 . . . . 0.0 111.02 -169.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -73.18 -172.38 1.0 Allowed 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.494 2.796 . . . . 0.0 110.698 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -55.88 -13.69 1.98 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.714 1.606 . . . . 0.0 113.939 172.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.81 -3.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.048 1.739 . . . . 0.0 114.527 170.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.457 HG23 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm -135.4 136.78 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -172.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.457 ' CH2' HG23 ' B' ' 683' ' ' ILE . 53.8 m0 -59.49 -45.11 92.63 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? -65.73 -45.75 81.5 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 125.326 1.451 . . . . 0.0 111.39 175.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -61.93 -49.17 77.22 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -175.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 39.8 p -77.4 -29.14 52.97 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.852 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 126.796 2.141 . . . . 0.0 112.53 179.544 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.23 18.29 13.03 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.3 mp 62.38 -29.75 0.08 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 169.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 83.3 mmt-85 -66.65 173.55 3.38 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.807 1.64 . . . . 0.0 112.259 -169.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -169.3 38.67 0.2 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -175.124 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -133.39 18.0 4.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.848 0.859 . . . . 0.0 112.262 -170.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.47 129.98 11.44 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.933 0.893 . . . . 0.0 109.291 -173.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 77.1 t80 40.77 57.71 8.22 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.627 1.571 . . . . 0.0 113.364 -178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.21 -170.28 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.369 2.046 . . . . 0.0 110.196 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 3.8 p -55.32 -17.61 5.01 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.061 1.344 . . . . 0.0 113.44 171.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.97 -1.31 0.28 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.285 1.834 . . . . 0.0 115.702 175.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.406 HG23 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm -133.92 138.36 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -172.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.406 ' CH2' HG23 ' B' ' 683' ' ' ILE . 52.9 m0 -62.24 -43.68 98.28 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 47.0 pttt -80.32 -28.66 38.15 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.534 -0.745 . . . . 0.0 112.089 178.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -62.47 -49.7 74.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.234 0.924 . . . . 0.0 109.498 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.2 p -72.48 -35.68 68.27 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.182 0.301 . . . . 0.0 110.333 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.189 0 C-N-CA 128.578 2.99 . . . . 0.0 113.929 174.164 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.483 HD22 ' H ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.97 20.4 3.25 Favored 'General case' 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.483 ' H ' HD22 ' A' ' 71' ' ' LEU . 1.2 mm? 67.33 -60.78 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.785 1.234 . . . . 0.0 113.835 169.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.91 167.52 20.54 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 126.825 2.05 . . . . 0.0 108.821 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.45 -40.01 0.08 OUTLIER Glycine 0 CA--C 1.533 1.211 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 169.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 N-CA-C 108.376 -1.89 . . . . 0.0 108.376 175.363 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.91 -0.383 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -140.17 159.48 42.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.05 0.94 . . . . 0.0 109.5 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.65 173.41 13.93 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.813 2.445 . . . . 0.0 106.625 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -140.08 -82.61 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 116.187 -1.863 . . . . 0.0 108.084 173.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.13 170.22 20.86 Favored 'Trans proline' 0 C--N 1.351 0.681 0 CA-C-N 122.986 2.102 . . . . 0.0 109.232 169.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.5 m -59.41 -17.47 30.84 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.241 1.016 . . . . 0.0 112.695 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -64.43 -1.76 1.91 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.437 1.895 . . . . 0.0 114.69 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 mm -129.99 138.72 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 119.541 1.064 . . . . 0.0 109.03 -175.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -61.77 -48.83 78.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.5 pttt -72.36 -28.29 62.94 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.707 -0.621 . . . . 0.0 112.449 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -63.49 -49.63 72.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.131 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 13.4 p -67.15 -43.71 81.62 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.213 0 C-N-CA 127.388 2.423 . . . . 0.0 113.125 170.688 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -102.6 9.05 39.6 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 mp 65.68 -48.69 0.39 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.356 1.462 . . . . 0.0 113.078 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -161.35 174.25 13.8 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 125.875 1.67 . . . . 0.0 109.968 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.88 0.17 4.04 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.101 1.334 . . . . 0.0 112.084 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.387 0 C-N-CA 125.787 1.66 . . . . 0.0 109.411 175.269 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.74 167.83 21.16 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.689 1.196 . . . . 0.0 110.27 -172.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 82.7 mtp -70.33 157.92 36.87 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 169.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.255 61.2 m-85 -121.75 -102.2 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 169.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.04 165.25 31.92 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 CA-C-N 124.35 2.589 . . . . 0.0 106.981 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.7 m -57.4 -19.28 22.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.014 0.926 . . . . 0.0 113.158 -177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.17 -7.48 9.2 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 126.931 2.093 . . . . 0.0 115.436 176.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 3.5 mm -132.13 137.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 119.531 1.06 . . . . 0.0 109.009 -169.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . 0.42 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . 0.42 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -59.35 -42.85 92.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -82.96 -23.86 33.23 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -71.74 -45.41 61.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.068 0.849 . . . . 0.0 110.007 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.4 m -86.09 -25.63 25.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.947 1.299 . . . . 0.0 109.866 -171.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.268 1.889 . . . . 0.0 111.673 173.215 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -119.97 18.31 12.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 64.59 -24.68 0.08 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -65.68 167.31 9.36 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 120.279 1.4 . . . . 0.0 111.541 -174.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.52 39.86 0.18 Allowed Glycine 0 CA--C 1.529 0.93 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 -169.825 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -140.56 154.94 46.71 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.873 1.269 . . . . 0.0 108.096 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 53.3 mtt -79.05 44.57 0.57 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.667 1.187 . . . . 0.0 113.211 -172.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.54 52.22 0.51 Allowed Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.755 2.422 . . . . 0.0 107.415 169.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -74.84 -168.87 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.621 2.881 . . . . 0.0 111.024 -169.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -51.62 -16.88 0.71 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.851 1.66 . . . . 0.0 113.767 170.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.1 -8.0 0.41 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.763 2.025 . . . . 0.0 114.474 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . 0.448 HG22 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm -134.69 136.79 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -172.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . 0.448 ' CH2' HG22 ' B' ' 683' ' ' ILE . 41.4 m0 -61.87 -48.82 78.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -77.34 -30.79 54.11 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -63.4 -48.41 77.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.997 0.817 . . . . 0.0 110.305 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.4 p -70.42 -44.84 67.07 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.294 0 C-N-CA 125.621 1.581 . . . . 0.0 110.52 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.49 20.28 11.87 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.2 mp 56.87 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 120.122 3.378 . . . . 0.0 120.122 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.89 169.54 7.98 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 121.468 1.94 . . . . 0.0 111.542 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -175.69 38.46 0.1 Allowed Glycine 0 CA--C 1.532 1.149 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.331 0 N-CA-C 108.961 -1.656 . . . . 0.0 108.961 -173.193 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 120.91 0.172 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 31.6 m80 53.45 31.45 12.2 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.093 1.757 . . . . 0.0 113.21 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -161.25 141.11 10.64 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.413 2.285 . . . . 0.0 105.467 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -131.93 -85.13 0.0 OUTLIER Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.742 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.44 165.87 30.74 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 CA-C-N 123.048 2.124 . . . . 0.0 108.71 169.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.2 m -60.56 -11.3 6.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.034 1.334 . . . . 0.0 113.598 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -71.61 -4.15 25.48 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.908 2.083 . . . . 0.0 115.128 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 3.0 mm -130.98 148.67 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -169.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -59.41 -41.0 88.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -84.29 -24.75 29.74 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -65.78 -46.11 79.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.555 -0.735 . . . . 0.0 110.508 175.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.0 p -69.2 -47.72 64.06 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 C-N-CA 125.793 1.663 . . . . 0.0 111.632 173.261 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -104.58 10.86 34.8 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.7 mp 66.26 -42.96 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.233 1.413 . . . . 0.0 114.019 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -164.74 166.15 20.14 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.505 1.522 . . . . 0.0 110.162 -171.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.6 26.21 3.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.679 1.133 . . . . 0.0 111.685 174.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 125.834 1.683 . . . . 0.0 109.048 176.421 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 113.804 0.282 . . . . 0.0 113.804 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -130.17 169.65 15.08 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.173 0.989 . . . . 0.0 108.638 -174.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -139.97 156.7 46.52 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 128.102 2.561 . . . . 0.0 104.376 171.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.259 62.9 m-85 -122.72 -91.47 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-O 115.659 -2.115 . . . . 0.0 107.609 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.29 161.4 46.13 Favored 'Trans proline' 0 C--N 1.352 0.738 0 CA-C-N 123.512 2.29 . . . . 0.0 108.621 169.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -58.78 -15.75 13.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.257 1.023 . . . . 0.0 112.673 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -60.74 -6.95 1.96 Allowed 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 127.962 2.505 . . . . 0.0 115.538 174.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 683' ' ' ILE . . . . . . . . . . . . . 2.6 mm -131.01 142.47 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 119.732 1.151 . . . . 0.0 109.124 -169.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 47.8 m0 -57.95 -47.03 84.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -78.53 -26.11 45.7 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -73.05 -43.26 62.2 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.825 0.739 . . . . 0.0 110.428 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 31.3 m -88.95 -25.55 22.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.882 1.273 . . . . 0.0 109.967 -169.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.26 0 C-N-CA 126.423 1.963 . . . . 0.0 111.862 172.586 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.537 HD12 HG23 ' B' ' 683' ' ' ILE . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.442 HG21 HD21 ' A' ' 56' ' ' LEU . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.555 HD11 HG11 ' B' ' 695' ' ' VAL . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.607 ' HB3' HD21 ' A' ' 50' ' ' LEU . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.607 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 26' ' ' VAL . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 8' ' ' LEU . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.653 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.555 HG11 HD11 ' A' ' 44' ' ' ILE . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.653 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.618 ' HB ' HG23 ' A' ' 9' ' ' THR . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.618 HG23 ' HB ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD11 HG11 ' B' ' 695' ' ' VAL . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.614 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.614 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.518 ' CG ' HD22 ' A' ' 50' ' ' LEU . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 . . . . . 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 8' ' ' LEU . 2.1 mm . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 44' ' ' ILE . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.455 ' CH2' HG21 ' B' ' 683' ' ' ILE . 46.7 m0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.456 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.435 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.412 HG13 ' HB3' ' A' ' 50' ' ' LEU . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.548 HG21 HD21 ' A' ' 56' ' ' LEU . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG3' HD11 ' A' ' 13' ' ' ILE . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.637 HD11 HG11 ' B' ' 695' ' ' VAL . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 44' ' ' ILE . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.412 ' HB3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.548 HD21 HG21 ' A' ' 26' ' ' VAL . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.447 HG11 HD12 ' A' ' 44' ' ' ILE . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.54 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.637 HG11 HD11 ' A' ' 44' ' ' ILE . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.54 ' CH2' HG21 ' B' ' 683' ' ' ILE . 44.7 m0 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' B' ' 687' ' ' VAL . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.574 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.512 HD11 HG11 ' B' ' 695' ' ' VAL . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.611 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.503 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.693 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm . . . . . 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 687' ' ' VAL . . . . . 0.485 HG22 ' HE2' ' A' ' 6' ' ' LYS . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 44' ' ' ILE . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.693 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.4 m0 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.427 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 HG12 ' A' ' 70' ' ' VAL . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.421 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HG3' HD11 ' A' ' 13' ' ' ILE . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.596 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.528 ' CG ' HD22 ' A' ' 50' ' ' LEU . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.475 HG12 HD21 ' A' ' 8' ' ' LEU . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.523 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.523 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.1 m0 . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.468 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.487 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.447 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HG3' HD11 ' A' ' 13' ' ' ILE . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.503 HD11 HG11 ' B' ' 695' ' ' VAL . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 45' ' ' PHE . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.525 ' CG ' HD22 ' A' ' 50' ' ' LEU . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.498 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.541 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.541 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.418 ' HE2' HG22 ' B' ' 687' ' ' VAL . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.437 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG3' HD11 ' A' ' 13' ' ' ILE . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 43' ' ' LEU . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HG11 ' B' ' 695' ' ' VAL . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB3' HD21 ' A' ' 50' ' ' LEU . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.421 HG12 HD21 ' A' ' 8' ' ' LEU . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.543 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.7 mm . . . . . 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 687' ' ' VAL . . . . . 0.418 HG22 ' HE2' ' A' ' 6' ' ' LYS . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 44' ' ' ILE . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.518 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.434 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.469 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.419 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.457 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.602 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' B' ' 692' ' ' PRO . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.517 ' CG ' HD22 ' A' ' 50' ' ' LEU . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.457 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.61 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 691' ' ' LEU . . . . . 0.407 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 692' ' ' PRO . . . . . 0.42 ' HD3' ' HA2' ' A' ' 47' ' ' GLY . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.61 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 . . . . . 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.44 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 HD21 ' A' ' 56' ' ' LEU . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.44 ' HG3' HD11 ' A' ' 13' ' ' ILE . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.429 HD21 HG21 ' A' ' 26' ' ' VAL . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.469 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.519 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' B' ' 683' ' ' ILE . 45.8 m0 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.446 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.511 HD21 HG12 ' A' ' 70' ' ' VAL . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.505 HG21 HD21 ' A' ' 56' ' ' LEU . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HG3' HD11 ' A' ' 13' ' ' ILE . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.44 HD11 HG11 ' B' ' 695' ' ' VAL . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.464 ' HB3' HD11 ' A' ' 50' ' ' LEU . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.464 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 26' ' ' VAL . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.43 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.511 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.44 HG11 HD11 ' A' ' 44' ' ' ILE . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.0 m0 . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG2' HD21 ' A' ' 15' ' ' LEU . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.43 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.607 ' HB3' HG23 ' B' ' 683' ' ' ILE . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD21 ' CG2' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.402 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.411 HG23 ' O ' ' A' ' 48' ' ' LYS . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.607 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.1 mm . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 691' ' ' LEU . . . . . 0.801 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 692' ' ' PRO . . . . . 0.801 ' HD2' HD13 ' B' ' 691' ' ' LEU . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.504 ' HB ' HD12 ' B' ' 691' ' ' LEU . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.464 ' CH2' HG21 ' B' ' 683' ' ' ILE . 37.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.469 HD11 HG11 ' B' ' 695' ' ' VAL . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.52 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.499 ' CG ' HD22 ' A' ' 50' ' ' LEU . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.415 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.5 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.469 HG11 HD11 ' A' ' 44' ' ' ILE . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.5 ' CH2' HG21 ' B' ' 683' ' ' ILE . 42.6 m0 . . . . . 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 70' ' ' VAL . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.494 HG21 HD21 ' A' ' 56' ' ' LEU . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.597 HD11 HG11 ' B' ' 695' ' ' VAL . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 50' ' ' LEU . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' ILE . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.409 HD12 ' CD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 HG21 ' A' ' 26' ' ' VAL . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.409 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.507 HG12 HD21 ' A' ' 8' ' ' LEU . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.424 HG23 ' CB ' ' A' ' 8' ' ' LEU . 1.2 mm . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.597 HG11 HD11 ' A' ' 44' ' ' ILE . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 34.6 m0 . . . . . 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.419 ' HD3' HG13 ' B' ' 687' ' ' VAL . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.407 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.546 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.516 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm . . . . . 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 687' ' ' VAL . . . . . 0.419 HG13 ' HD3' ' A' ' 6' ' ' LYS . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.516 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.8 m0 . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HD3' HG13 ' B' ' 687' ' ' VAL . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.444 ' OG1' HG22 ' A' ' 9' ' ' THR . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 70' ' ' VAL . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.444 HG22 ' OG1' ' A' ' 7' ' ' THR . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.528 HD11 HG11 ' B' ' 695' ' ' VAL . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.636 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.636 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.464 HG12 HD21 ' A' ' 8' ' ' LEU . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.635 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm . . . . . 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 687' ' ' VAL . . . . . 0.425 HG13 ' HD3' ' A' ' 6' ' ' LYS . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 691' ' ' LEU . . . . . 0.736 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 692' ' ' PRO . . . . . 0.736 ' HD2' HD13 ' B' ' 691' ' ' LEU . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.528 HG11 HD11 ' A' ' 44' ' ' ILE . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' B' ' 683' ' ' ILE . 52.9 m0 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.44 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.407 ' HG3' HD21 ' A' ' 69' ' ' LEU . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 HG11 ' B' ' 695' ' ' VAL . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.67 ' HB3' HD21 ' A' ' 50' ' ' LEU . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.576 ' CG ' HD22 ' A' ' 50' ' ' LEU . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.492 HG12 HD21 ' A' ' 8' ' ' LEU . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.649 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.448 HG11 HD11 ' A' ' 44' ' ' ILE . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.649 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.8 m0 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.4 HG13 ' HB3' ' A' ' 50' ' ' LEU . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.518 HG21 HD21 ' A' ' 56' ' ' LEU . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' A' ' 13' ' ' ILE . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.452 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.521 HD11 HG11 ' B' ' 695' ' ' VAL . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.475 ' HB3' HD11 ' A' ' 50' ' ' LEU . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.518 HD21 HG21 ' A' ' 26' ' ' VAL . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CD1' HD12 ' A' ' 50' ' ' LEU . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 8' ' ' LEU . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 . . . . . 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.687 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.5 mm . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 689' ' ' TYR . . . . . 0.402 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 691' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 44' ' ' ILE . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.687 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.3 m0 . . . . . 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG21 HD11 ' A' ' 30' ' ' ILE . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG12 ' A' ' 70' ' ' VAL . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.46 HG21 HD21 ' A' ' 56' ' ' LEU . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.407 HD11 HG21 ' A' ' 5' ' ' VAL . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.634 HD11 HG11 ' B' ' 695' ' ' VAL . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 26' ' ' VAL . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.436 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.448 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.491 HG21 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 691' ' ' LEU . . . . . 0.404 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 692' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 691' ' ' LEU . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.634 HG11 HD11 ' A' ' 44' ' ' ILE . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.491 ' CH2' HG21 ' B' ' 683' ' ' ILE . 41.4 m0 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.46 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.459 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.44 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.623 HD11 HG11 ' B' ' 695' ' ' VAL . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.45 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.427 HG12 HD21 ' A' ' 8' ' ' LEU . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.58 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.0 mm . . . . . 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.623 HG11 HD11 ' A' ' 44' ' ' ILE . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.58 ' CH2' HG21 ' B' ' 683' ' ' ILE . 48.2 m0 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.455 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.406 HG13 ' HB3' ' A' ' 50' ' ' LEU . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 56' ' ' LEU . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' HB3' HG22 ' A' ' 70' ' ' VAL . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.551 HD11 HG11 ' B' ' 695' ' ' VAL . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.406 ' HB3' HG13 ' A' ' 23' ' ' ILE . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD21 HG21 ' A' ' 26' ' ' VAL . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.489 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 683' ' ' ILE . . . . . 0.601 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 695' ' ' VAL . . . . . 0.551 HG11 HD11 ' A' ' 44' ' ' ILE . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 703' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.8 m0 . . . . . 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.537 HD12 HG23 ' B' ' 683' ' ' ILE . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.442 HG21 HD21 ' A' ' 56' ' ' LEU . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.555 HD11 HG11 ' B' ' 695' ' ' VAL . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.607 ' HB3' HD21 ' A' ' 50' ' ' LEU . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.607 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 26' ' ' VAL . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 8' ' ' LEU . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.5 24.83 8.47 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 70.2 -57.24 0.57 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.96 1.704 . . . . 0.0 113.507 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -161.64 -178.29 6.46 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 120.03 1.287 . . . . 0.0 110.853 -169.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -165.19 -46.27 0.02 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 169.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 174.309 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 111.669 -0.572 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -134.63 12.65 3.74 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.339 1.056 . . . . 0.0 112.468 -171.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -160.67 167.87 26.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.814 1.246 . . . . 0.0 109.215 177.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -142.97 -75.94 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 116.471 -1.728 . . . . 0.0 107.815 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.46 168.3 24.04 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 122.376 1.884 . . . . 0.0 109.211 169.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -59.53 -17.04 28.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.177 0.991 . . . . 0.0 112.691 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -66.61 -0.1 2.64 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.119 1.368 . . . . 0.0 114.288 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.653 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm -130.08 143.35 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 120.101 1.319 . . . . 0.0 110.023 -175.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.555 HG11 HD11 ' A' ' 44' ' ' ILE . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.653 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 -60.35 -46.89 88.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -42.44 98.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 125.064 1.345 . . . . 0.0 110.775 175.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -66.32 -49.7 66.12 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.692 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.4 p -73.27 -26.34 61.05 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 118.769 0.713 . . . . 0.0 110.488 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 128.091 2.757 . . . . 0.0 112.651 177.113 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.618 ' HB ' HG23 ' A' ' 9' ' ' THR . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.618 HG23 ' HB ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD11 HG11 ' B' ' 695' ' ' VAL . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.614 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.614 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.518 ' CG ' HD22 ' A' ' 50' ' ' LEU . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.491 ' C ' HD12 ' A' ' 73' ' ' LEU . 1.6 ptt180 -109.77 17.78 20.87 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.5 mp 65.7 -43.8 0.37 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.504 1.922 . . . . 0.0 115.337 172.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 ptt85 -158.55 172.56 18.08 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.619 1.554 . . . . 0.0 110.472 -169.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.1 34.87 1.89 Allowed Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.292 0.949 . . . . 0.0 110.988 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.507 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.47 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 112.347 -0.301 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.66 21.5 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 111.518 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.08 172.93 17.31 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.679 1.592 . . . . 0.0 108.506 -178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.257 51.6 t80 49.28 60.21 15.85 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.958 0.903 . . . . 0.0 110.494 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -65.19 -175.46 0.4 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 123.908 3.072 . . . . 0.0 111.115 170.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -52.93 -14.65 0.6 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.952 1.701 . . . . 0.0 113.64 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 9' ' ' THR . 10.8 t70 -57.45 -14.77 5.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.652 1.181 . . . . 0.0 112.372 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 8' ' ' LEU . 2.1 mm -136.88 152.17 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 -177.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 44' ' ' ILE . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.403 ' HB3' HD13 ' A' ' 73' ' ' LEU . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.455 ' CH2' HG21 ' B' ' 683' ' ' ILE . 46.7 m0 -57.76 -47.6 82.04 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -78.8 -27.68 44.48 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.636 -0.665 . . . . 0.0 112.698 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 -72.34 -46.83 53.83 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.069 0.85 . . . . 0.0 110.486 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.6 m -82.98 -37.99 23.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 124.932 1.293 . . . . 0.0 109.269 -169.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.297 -1.28 . . . . 0.0 110.591 -177.032 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.456 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.413 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.435 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.412 HG13 ' HB3' ' A' ' 50' ' ' LEU . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.548 HG21 HD21 ' A' ' 56' ' ' LEU . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG3' HD11 ' A' ' 13' ' ' ILE . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.637 HD11 HG11 ' B' ' 695' ' ' VAL . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 44' ' ' ILE . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.412 ' HB3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.548 HD21 HG21 ' A' ' 26' ' ' VAL . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.447 HG11 HD12 ' A' ' 44' ' ' ILE . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.691 ' C ' HD13 ' A' ' 73' ' ' LEU . 2.5 ppt_? -108.28 24.76 12.53 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.691 HD13 ' C ' ' A' ' 72' ' ' ARG 0.284 0.0 OUTLIER 46.46 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 168.044 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -143.85 148.67 35.82 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 124.074 3.125 . . . . 0.0 110.739 174.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -89.83 65.8 2.92 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 169.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 -177.736 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 CA-C-O 121.361 0.423 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -140.66 163.5 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.454 1.502 . . . . 0.0 108.941 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.5 mmt -68.28 158.67 32.89 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.014 0.526 . . . . 0.0 109.839 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 89.5 t80 46.36 57.26 16.74 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.697 0.799 . . . . 0.0 111.221 -169.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -72.71 -172.34 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.563 2.842 . . . . 0.0 110.391 173.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.8 m -60.4 11.72 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.94 2.096 . . . . 0.0 114.465 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.413 ' C ' ' HB ' ' A' ' 9' ' ' THR . 30.2 t70 -84.63 -3.58 58.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.282 1.833 . . . . 0.0 112.444 169.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.54 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -135.73 142.35 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -170.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.637 HG11 HD11 ' A' ' 44' ' ' ILE . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.504 ' HB3' HD21 ' A' ' 73' ' ' LEU . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.54 ' CH2' HG21 ' B' ' 683' ' ' ILE . 44.7 m0 -60.6 -49.98 75.35 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -31.53 66.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.423 -0.799 . . . . 0.0 112.328 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.1 mtm180 -67.78 -50.03 59.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.832 1.196 . . . . 0.0 111.181 176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.1 p -83.55 -21.18 32.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.658 0.383 . . . . 0.0 111.517 -171.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 126.245 1.879 . . . . 0.0 111.958 174.672 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' B' ' 687' ' ' VAL . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.574 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.512 HD11 HG11 ' B' ' 695' ' ' VAL . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.611 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.503 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.513 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -120.5 14.51 11.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 72' ' ' ARG . 3.3 mp 68.19 -59.52 0.44 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.2 1.8 . . . . 0.0 113.698 171.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -169.15 166.96 10.67 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.205 1.402 . . . . 0.0 110.609 -171.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -145.73 19.52 1.82 Allowed Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.103 1.335 . . . . 0.0 111.635 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.278 0 C-N-CA 126.992 2.234 . . . . 0.0 107.782 175.467 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.998 0.221 . . . . 0.0 112.643 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -71.49 -31.59 67.28 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 122.144 -0.621 . . . . 0.0 111.537 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 42.8 ttp -80.89 144.02 32.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 169.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.33 0.1 OUTLIER 36.66 53.33 2.46 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.821 2.048 . . . . 0.0 115.273 178.161 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -61.01 -176.67 0.16 Allowed 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.17 2.58 . . . . 0.0 109.47 169.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -49.2 -23.07 1.17 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.585 1.154 . . . . 0.0 113.963 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.6 -20.55 8.22 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.332 1.853 . . . . 0.0 115.238 171.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.693 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm -133.8 140.93 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -173.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 687' ' ' VAL . . . . . 0.485 HG22 ' HE2' ' A' ' 6' ' ' LYS . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 44' ' ' ILE . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 73' ' ' LEU . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.693 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.4 m0 -60.24 -36.58 78.09 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -86.83 -28.42 22.92 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.0 mtp85 -63.4 -45.76 89.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.07 0.85 . . . . 0.0 111.049 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 26.3 p -69.75 -51.78 31.17 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.327 0 C-N-CA 126.096 1.808 . . . . 0.0 111.17 178.636 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.427 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 HG12 ' A' ' 70' ' ' VAL . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.421 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HG3' HD11 ' A' ' 13' ' ' ILE . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.596 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.528 ' CG ' HD22 ' A' ' 50' ' ' LEU . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.475 HG12 HD21 ' A' ' 8' ' ' LEU . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.494 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.7 23.71 5.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 71' ' ' LEU . 1.4 mm? 70.38 -56.66 0.59 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.173 1.789 . . . . 0.0 113.618 169.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -162.66 160.34 25.52 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 120.291 1.405 . . . . 0.0 111.385 -172.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.66 31.79 1.76 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.071 1.319 . . . . 0.0 110.474 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.028 0 C-N-CA 127.348 2.404 . . . . 0.0 107.522 178.251 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.489 -0.645 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -133.54 169.96 16.22 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.945 1.298 . . . . 0.0 109.847 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -61.43 156.91 18.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.5 1.12 . . . . 0.0 110.887 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 93.3 t80 46.17 58.42 16.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 124.202 1.001 . . . . 0.0 111.229 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.61 -172.66 0.98 Allowed 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.213 2.609 . . . . 0.0 110.318 171.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -55.63 -14.69 2.31 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.218 1.407 . . . . 0.0 113.625 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -57.64 -7.31 0.64 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.916 1.687 . . . . 0.0 114.773 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.523 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -133.19 137.95 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 -174.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.523 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.1 m0 -62.29 -48.53 79.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.54 -29.72 61.49 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.677 -0.678 . . . . 0.0 112.577 178.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -66.03 -53.27 40.72 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.258 0.936 . . . . 0.0 110.597 176.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.9 p -81.01 -25.47 37.2 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 123.172 0.295 . . . . 0.0 110.82 -170.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 C-N-CA 126.273 1.892 . . . . 0.0 112.393 172.831 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.468 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.487 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.447 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HG3' HD11 ' A' ' 13' ' ' ILE . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.503 HD11 HG11 ' B' ' 695' ' ' VAL . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 45' ' ' PHE . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.525 ' CG ' HD22 ' A' ' 50' ' ' LEU . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.498 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.512 ' C ' HD12 ' A' ' 73' ' ' LEU . 10.8 ptm180 -109.68 15.01 23.11 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.512 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.2 mp 65.44 -50.05 0.37 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.985 1.714 . . . . 0.0 114.753 174.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -164.52 154.66 14.26 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.34 1.456 . . . . 0.0 109.403 -169.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.1 -26.45 73.78 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.581 0.628 . . . . 0.0 111.867 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.287 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 177.972 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 CA-C-O 120.96 0.2 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -68.92 -23.88 64.22 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.869 0.868 . . . . 0.0 113.06 -175.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.6 mmt -134.21 170.68 15.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.484 1.513 . . . . 0.0 109.378 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 48.14 57.44 17.98 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 111.423 -169.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -72.01 -172.92 0.93 Allowed 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 123.247 2.632 . . . . 0.0 110.516 170.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.7 m -55.88 -14.04 2.19 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.286 1.434 . . . . 0.0 113.948 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.43 -6.41 0.68 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.006 1.722 . . . . 0.0 114.805 170.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.541 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm -132.76 137.77 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -175.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.541 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 -60.78 -48.25 82.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -76.46 -32.31 58.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.611 -0.68 . . . . 0.0 112.336 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.26 -48.86 74.15 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.741 0.701 . . . . 0.0 110.431 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.7 p -78.7 -30.13 45.86 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.277 0.361 . . . . 0.0 110.957 -178.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.322 0 C-N-CA 126.985 2.231 . . . . 0.0 112.45 -177.769 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.418 ' HE2' HG22 ' B' ' 687' ' ' VAL . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.405 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.437 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG3' HD11 ' A' ' 13' ' ' ILE . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 43' ' ' LEU . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HG11 ' B' ' 695' ' ' VAL . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB3' HD21 ' A' ' 50' ' ' LEU . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.421 HG12 HD21 ' A' ' 8' ' ' LEU . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.433 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.26 21.2 3.72 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.576 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.5 mm? 59.47 -22.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 120.42 3.489 . . . . 0.0 120.42 168.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.03 171.4 6.89 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 121.48 1.946 . . . . 0.0 111.025 -175.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 174.48 -21.25 0.06 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.7 -0.625 . . . . 0.0 113.152 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 177.221 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.873 0 CA-C-O 121.26 0.367 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -69.86 -20.8 63.39 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -143.24 160.09 41.12 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.984 0.913 . . . . 0.0 109.671 177.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.327 0.3 OUTLIER 50.77 63.84 9.21 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 124.224 1.009 . . . . 0.0 111.485 -178.152 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.53 -171.54 0.96 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.139 1.893 . . . . 0.0 107.43 168.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -58.89 4.49 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 115.367 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.405 ' C ' ' HB ' ' A' ' 9' ' ' THR . 26.4 t70 -84.45 -15.15 47.12 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.745 1.618 . . . . 0.0 113.571 170.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.543 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.7 mm -132.8 159.05 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -170.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 687' ' ' VAL . . . . . 0.418 HG22 ' HE2' ' A' ' 6' ' ' LYS . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 44' ' ' ILE . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.576 ' CD1' HD21 ' A' ' 73' ' ' LEU . 49.6 m0 -60.87 -53.76 53.34 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -72.45 -30.9 64.99 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.6 mtp85 -63.92 -50.64 67.92 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 118.658 0.663 . . . . 0.0 110.533 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 30.9 p -69.83 -42.62 73.38 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.393 0 C-N-CA 126.234 1.873 . . . . 0.0 113.12 171.393 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.434 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.469 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.419 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.602 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' B' ' 692' ' ' PRO . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.517 ' CG ' HD22 ' A' ' 50' ' ' LEU . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.457 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.461 ' C ' HD12 ' A' ' 73' ' ' LEU . 4.4 ptt180 -115.28 15.58 16.91 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.5 mp 63.37 -20.24 0.06 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 118.559 2.8 . . . . 0.0 118.559 170.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -65.15 169.68 5.31 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.461 1.937 . . . . 0.0 110.457 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.08 -27.35 0.18 Allowed Glycine 0 CA--C 1.532 1.13 0 O-C-N 121.473 -0.767 . . . . 0.0 112.313 172.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 C-N-CA 125.663 1.602 . . . . 0.0 109.398 178.547 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 CA-C-O 121.168 0.315 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -68.14 159.57 30.75 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 122.079 -0.659 . . . . 0.0 110.781 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -68.43 161.81 26.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.28 1.032 . . . . 0.0 110.158 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.3 t80 47.73 59.19 16.98 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.772 0.829 . . . . 0.0 110.927 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.36 -173.39 0.94 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.03 2.487 . . . . 0.0 110.419 169.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.5 m -56.23 -13.25 1.98 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.242 1.417 . . . . 0.0 114.032 172.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.57 -5.08 0.49 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.139 1.776 . . . . 0.0 114.809 171.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.61 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm -134.58 140.03 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -173.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 691' ' ' LEU . . . . . 0.407 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 692' ' ' PRO . . . . . 0.42 ' HD3' ' HA2' ' A' ' 47' ' ' GLY . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.61 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 -59.32 -49.06 79.28 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -74.04 -28.62 61.5 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.465 -0.772 . . . . 0.0 112.565 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -72.87 -45.08 60.21 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.948 0.795 . . . . 0.0 110.116 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 32.9 m -87.52 -22.03 25.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.349 -169.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.303 0 C-N-CA 126.966 2.222 . . . . 0.0 112.758 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.44 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 HD21 ' A' ' 56' ' ' LEU . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.44 ' HG3' HD11 ' A' ' 13' ' ' ILE . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.429 HD21 HG21 ' A' ' 26' ' ' VAL . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.469 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.77 21.5 11.95 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 70.71 -63.55 0.41 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.895 1.278 . . . . 0.0 112.31 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -173.46 165.57 4.67 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 110.813 -169.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -93.61 -19.88 33.5 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.445 -0.642 . . . . 0.0 111.887 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 178.767 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -139.21 -27.39 0.81 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.64 1.576 . . . . 0.0 110.698 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.7 mmt -78.67 164.12 24.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.858 0.754 . . . . 0.0 110.167 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 47.54 57.39 17.75 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.098 0.959 . . . . 0.0 110.963 -169.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -71.24 -173.36 0.91 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.391 2.727 . . . . 0.0 110.522 169.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.4 m -55.76 -12.94 1.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.614 1.566 . . . . 0.0 113.931 172.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -59.1 -4.08 0.46 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.125 1.77 . . . . 0.0 114.546 171.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.519 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm -135.92 139.06 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -172.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' B' ' 683' ' ' ILE . 45.8 m0 -62.1 -45.78 92.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -77.37 -31.31 54.2 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.417 0.553 . . . . 0.0 112.418 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 9.5 mtp85 -62.24 -51.1 69.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.886 0.766 . . . . 0.0 110.694 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 27.2 p -72.13 -50.1 30.67 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.34 0 C-N-CA 125.439 1.495 . . . . 0.0 110.834 170.482 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.446 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.511 HD21 HG12 ' A' ' 70' ' ' VAL . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.435 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.505 HG21 HD21 ' A' ' 56' ' ' LEU . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HG3' HD11 ' A' ' 13' ' ' ILE . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.44 HD11 HG11 ' B' ' 695' ' ' VAL . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.464 ' HB3' HD11 ' A' ' 50' ' ' LEU . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.464 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 26' ' ' VAL . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.43 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.511 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.36 18.55 14.37 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.2 mm? 69.31 -57.25 0.53 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.223 1.409 . . . . 0.0 113.422 169.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -164.8 158.85 17.91 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 120.243 1.383 . . . . 0.0 110.414 -169.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -137.83 3.16 3.12 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.659 1.123 . . . . 0.0 112.282 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.446 0 N-CA-C 108.816 -1.714 . . . . 0.0 108.816 176.907 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -141.48 163.94 31.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.763 1.225 . . . . 0.0 109.887 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 56.9 mtt -68.39 162.77 24.66 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.29 -92.95 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 169.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -71.84 161.6 44.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 CA-C-N 123.561 2.308 . . . . 0.0 108.043 168.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -62.39 -9.8 9.4 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.127 0.971 . . . . 0.0 112.951 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.435 ' C ' ' HB ' ' A' ' 9' ' ' THR . 29.5 t70 -68.09 -4.86 14.92 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.061 175.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm -131.02 146.56 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 119.378 0.99 . . . . 0.0 109.256 -169.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.44 HG11 HD11 ' A' ' 44' ' ' ILE . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.433 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.0 m0 -61.07 -47.44 86.33 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -75.72 -26.51 57.56 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -74.02 -48.1 32.43 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.163 0.892 . . . . 0.0 109.817 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 33.2 m -79.95 -36.91 35.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.62 1.168 . . . . 0.0 109.187 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.126 -1.375 . . . . 0.0 110.619 -175.15 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG2' HD21 ' A' ' 15' ' ' LEU . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.43 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.607 ' HB3' HG23 ' B' ' 683' ' ' ILE . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD21 ' CG2' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.402 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.411 HG23 ' O ' ' A' ' 48' ' ' LYS . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.03 21.06 9.87 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.623 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.9 mm? 65.49 -33.43 0.17 Allowed 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 117.331 2.345 . . . . 0.0 117.331 169.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.7 167.48 7.31 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.637 1.108 . . . . 0.0 111.902 -169.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -172.09 40.41 0.17 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.172 0 N-CA-C 109.091 -1.603 . . . . 0.0 109.091 -174.015 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.096 0 CA-C-O 119.983 -0.343 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -73.84 0.31 13.63 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.315 1.057 . . . . 0.0 113.67 -176.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.66 158.3 44.04 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.094 1.758 . . . . 0.0 107.264 173.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -135.96 -78.62 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 116.548 -1.691 . . . . 0.0 108.0 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -72.99 167.03 28.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 122.254 1.841 . . . . 0.0 109.001 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.0 m -59.65 -17.18 31.8 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.146 0.978 . . . . 0.0 112.755 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -70.63 1.06 5.71 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.056 1.743 . . . . 0.0 114.469 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.607 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.1 mm -131.36 146.47 33.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 119.927 1.24 . . . . 0.0 109.337 -173.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 691' ' ' LEU . . . . . 0.801 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 692' ' ' PRO . . . . . 0.801 ' HD2' HD13 ' B' ' 691' ' ' LEU . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.504 ' HB ' HD12 ' B' ' 691' ' ' LEU . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.408 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.623 ' CD1' HD21 ' A' ' 73' ' ' LEU . 37.3 m0 -61.0 -50.14 74.6 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -69.39 -31.79 70.4 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.171 0.441 . . . . 0.0 111.84 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -74.14 -33.26 63.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.258 0.481 . . . . 0.0 111.386 -174.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 24.0 m -103.2 -19.42 14.51 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.687 1.595 . . . . 0.0 109.935 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.304 0 C-N-CA 126.911 2.196 . . . . 0.0 111.782 172.228 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.404 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.469 HD11 HG11 ' B' ' 695' ' ' VAL . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.52 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.499 ' CG ' HD22 ' A' ' 50' ' ' LEU . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.415 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.35 20.79 11.87 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.582 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.8 mm? 63.75 -33.91 0.14 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 169.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -67.52 169.52 9.06 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.754 1.615 . . . . 0.0 111.213 -169.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.32 42.35 0.27 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.243 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -174.913 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.814 -0.514 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -133.13 20.37 4.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 111.702 -170.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -123.32 141.32 52.11 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 -177.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.6 t80 47.25 54.25 15.13 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 123.799 0.839 . . . . 0.0 110.669 -168.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -74.61 -169.77 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.301 2.668 . . . . 0.0 110.245 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -60.88 15.83 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.26 2.224 . . . . 0.0 114.136 169.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.404 ' C ' ' HB ' ' A' ' 9' ' ' THR . 34.8 t70 -94.36 -0.98 54.53 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.756 1.622 . . . . 0.0 111.841 169.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.5 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm -135.71 143.18 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -174.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.469 HG11 HD11 ' A' ' 44' ' ' ILE . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.429 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.582 ' CD1' HD21 ' A' ' 73' ' ' LEU . 42.6 m0 -60.4 -46.84 88.57 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 54.4 pttt -79.18 -25.89 42.72 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -72.24 -45.33 60.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.271 0.941 . . . . 0.0 109.164 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.7 m -80.48 -31.27 37.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.326 -170.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.214 0 C-N-CA 126.069 1.795 . . . . 0.0 111.931 172.83 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 70' ' ' VAL . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.42 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.494 HG21 HD21 ' A' ' 56' ' ' LEU . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.597 HD11 HG11 ' B' ' 695' ' ' VAL . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 50' ' ' LEU . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' ILE . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.409 HD12 ' CD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 HG21 ' A' ' 26' ' ' VAL . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.409 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.507 HG12 HD21 ' A' ' 8' ' ' LEU . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' H ' ' A' ' 73' ' ' LEU . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? -121.89 25.27 9.24 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.468 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.2 mm? 66.47 -52.69 0.43 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 169.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt85 -157.39 168.45 27.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 120.887 1.676 . . . . 0.0 112.165 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.37 -37.0 54.53 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 123.71 0.671 . . . . 0.0 112.747 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.0 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -177.885 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -60.85 152.89 26.04 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.79 0.836 . . . . 0.0 111.254 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.12 156.55 17.9 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.702 0.801 . . . . 0.0 111.588 170.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 3.7 t80 42.12 63.42 6.8 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 125.345 1.458 . . . . 0.0 111.202 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -71.58 -171.36 0.63 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.191 1.927 . . . . 0.0 108.988 169.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -60.43 17.01 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.452 1.901 . . . . 0.0 114.108 169.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.42 ' C ' ' HB ' ' A' ' 9' ' ' THR . 31.3 t70 -95.3 -7.7 38.0 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 127.152 2.181 . . . . 0.0 112.356 171.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.424 HG23 ' CB ' ' A' ' 8' ' ' LEU . 1.2 mm -133.46 147.45 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -173.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.597 HG11 HD11 ' A' ' 44' ' ' ILE . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.468 ' CD1' HD21 ' A' ' 73' ' ' LEU . 34.6 m0 -62.07 -49.82 74.43 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -72.28 -24.09 61.29 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.171 0.896 . . . . 0.0 112.59 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -66.55 -49.84 65.14 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.386 0.994 . . . . 0.0 110.626 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 29.7 p -71.24 -39.56 71.58 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.609 1.095 . . . . 0.0 109.305 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.332 0 C-N-CA 126.875 2.179 . . . . 0.0 111.51 175.677 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.419 ' HD3' HG13 ' B' ' 687' ' ' VAL . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.407 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.546 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.494 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.7 OUTLIER -113.16 17.66 18.53 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.1 mp 64.48 -44.98 0.31 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 172.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -157.76 178.64 10.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.92 1.691 . . . . 0.0 111.254 -169.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.12 44.28 2.6 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.697 1.141 . . . . 0.0 113.105 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.238 0 N-CA-C 108.043 -2.023 . . . . 0.0 108.043 -176.106 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.947 0 CA-C-O 121.657 0.587 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -65.13 155.4 34.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.699 0.8 . . . . 0.0 110.825 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.1 mmt -68.1 158.15 33.7 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 84.4 t80 48.68 57.48 18.2 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 123.377 0.671 . . . . 0.0 111.02 -169.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -73.18 -172.38 1.0 Allowed 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.494 2.796 . . . . 0.0 110.698 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -55.88 -13.69 1.98 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.714 1.606 . . . . 0.0 113.939 172.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.81 -3.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.048 1.739 . . . . 0.0 114.527 170.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.516 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm -135.4 136.78 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -172.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 687' ' ' VAL . . . . . 0.419 HG13 ' HD3' ' A' ' 6' ' ' LYS . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.401 ' CB ' HD13 ' A' ' 73' ' ' LEU . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.516 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.8 m0 -59.49 -45.11 92.63 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? -65.73 -45.75 81.5 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 125.326 1.451 . . . . 0.0 111.39 175.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -61.93 -49.17 77.22 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -175.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 39.8 p -77.4 -29.14 52.97 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.852 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 126.796 2.141 . . . . 0.0 112.53 179.544 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HD3' HG13 ' B' ' 687' ' ' VAL . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.444 ' OG1' HG22 ' A' ' 9' ' ' THR . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 70' ' ' VAL . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.444 HG22 ' OG1' ' A' ' 7' ' ' THR . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.528 HD11 HG11 ' B' ' 695' ' ' VAL . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.636 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.636 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.464 HG12 HD21 ' A' ' 8' ' ' LEU . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.482 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -119.23 18.29 13.03 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.3 mp 62.38 -29.75 0.08 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 169.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 83.3 mmt-85 -66.65 173.55 3.38 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.807 1.64 . . . . 0.0 112.259 -169.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -169.3 38.67 0.2 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -175.124 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -133.39 18.0 4.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.848 0.859 . . . . 0.0 112.262 -170.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.47 129.98 11.44 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.933 0.893 . . . . 0.0 109.291 -173.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 77.1 t80 40.77 57.71 8.22 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.627 1.571 . . . . 0.0 113.364 -178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.21 -170.28 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.369 2.046 . . . . 0.0 110.196 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 3.8 p -55.32 -17.61 5.01 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.061 1.344 . . . . 0.0 113.44 171.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.97 -1.31 0.28 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.285 1.834 . . . . 0.0 115.702 175.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.635 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm -133.92 138.36 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -172.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 687' ' ' VAL . . . . . 0.425 HG13 ' HD3' ' A' ' 6' ' ' LYS . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 691' ' ' LEU . . . . . 0.736 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 692' ' ' PRO . . . . . 0.736 ' HD2' HD13 ' B' ' 691' ' ' LEU . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.528 HG11 HD11 ' A' ' 44' ' ' ILE . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' B' ' 683' ' ' ILE . 52.9 m0 -62.24 -43.68 98.28 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 47.0 pttt -80.32 -28.66 38.15 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.534 -0.745 . . . . 0.0 112.089 178.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -62.47 -49.7 74.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.234 0.924 . . . . 0.0 109.498 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.2 p -72.48 -35.68 68.27 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.182 0.301 . . . . 0.0 110.333 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.189 0 C-N-CA 128.578 2.99 . . . . 0.0 113.929 174.164 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.44 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.418 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.407 ' HG3' HD21 ' A' ' 69' ' ' LEU . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 HG11 ' B' ' 695' ' ' VAL . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.67 ' HB3' HD21 ' A' ' 50' ' ' LEU . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.576 ' CG ' HD22 ' A' ' 50' ' ' LEU . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.492 HG12 HD21 ' A' ' 8' ' ' LEU . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.546 HD22 ' H ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.97 20.4 3.25 Favored 'General case' 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 71' ' ' LEU . 1.2 mm? 67.33 -60.78 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.785 1.234 . . . . 0.0 113.835 169.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.91 167.52 20.54 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 126.825 2.05 . . . . 0.0 108.821 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.45 -40.01 0.08 OUTLIER Glycine 0 CA--C 1.533 1.211 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 169.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 N-CA-C 108.376 -1.89 . . . . 0.0 108.376 175.363 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.91 -0.383 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -140.17 159.48 42.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.05 0.94 . . . . 0.0 109.5 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.65 173.41 13.93 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.813 2.445 . . . . 0.0 106.625 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 679' ' ' PHE . . . . . 0.417 ' CD2' ' HD3' ' B' ' 680' ' ' PRO . 15.5 t80 -140.08 -82.61 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 116.187 -1.863 . . . . 0.0 108.084 173.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 680' ' ' PRO . . . . . 0.417 ' HD3' ' CD2' ' B' ' 679' ' ' PHE . 96.1 Cg_endo -75.13 170.22 20.86 Favored 'Trans proline' 0 C--N 1.351 0.681 0 CA-C-N 122.986 2.102 . . . . 0.0 109.232 169.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.5 m -59.41 -17.47 30.84 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.241 1.016 . . . . 0.0 112.695 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.418 ' C ' ' HB ' ' A' ' 9' ' ' THR . 35.6 t70 -64.43 -1.76 1.91 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.437 1.895 . . . . 0.0 114.69 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.649 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm -129.99 138.72 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 119.541 1.064 . . . . 0.0 109.03 -175.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.448 HG11 HD11 ' A' ' 44' ' ' ILE . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.649 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.8 m0 -61.77 -48.83 78.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.5 pttt -72.36 -28.29 62.94 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.707 -0.621 . . . . 0.0 112.449 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -63.49 -49.63 72.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.131 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 13.4 p -67.15 -43.71 81.62 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.213 0 C-N-CA 127.388 2.423 . . . . 0.0 113.125 170.688 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.4 HG13 ' HB3' ' A' ' 50' ' ' LEU . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.518 HG21 HD21 ' A' ' 56' ' ' LEU . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' A' ' 13' ' ' ILE . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.452 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.521 HD11 HG11 ' B' ' 695' ' ' VAL . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.475 ' HB3' HD11 ' A' ' 50' ' ' LEU . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.518 HD21 HG21 ' A' ' 26' ' ' VAL . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CD1' HD12 ' A' ' 50' ' ' LEU . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 8' ' ' LEU . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.568 ' C ' HD12 ' A' ' 73' ' ' LEU . 21.7 ptt180 -102.6 9.05 39.6 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 72' ' ' ARG . 1.5 mp 65.68 -48.69 0.39 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.356 1.462 . . . . 0.0 113.078 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -161.35 174.25 13.8 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 125.875 1.67 . . . . 0.0 109.968 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.88 0.17 4.04 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.101 1.334 . . . . 0.0 112.084 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.387 0 C-N-CA 125.787 1.66 . . . . 0.0 109.411 175.269 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.74 167.83 21.16 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.689 1.196 . . . . 0.0 110.27 -172.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 82.7 mtp -70.33 157.92 36.87 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 169.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.255 61.2 m-85 -121.75 -102.2 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 169.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.04 165.25 31.92 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 CA-C-N 124.35 2.589 . . . . 0.0 106.981 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.7 m -57.4 -19.28 22.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.014 0.926 . . . . 0.0 113.158 -177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.17 -7.48 9.2 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 126.931 2.093 . . . . 0.0 115.436 176.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.687 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.5 mm -132.13 137.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 119.531 1.06 . . . . 0.0 109.009 -169.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 689' ' ' TYR . . . . . 0.402 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 691' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 44' ' ' ILE . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.499 ' CB ' HD13 ' A' ' 73' ' ' LEU . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.687 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.3 m0 -59.35 -42.85 92.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -82.96 -23.86 33.23 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -71.74 -45.41 61.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.068 0.849 . . . . 0.0 110.007 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.4 m -86.09 -25.63 25.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.947 1.299 . . . . 0.0 109.866 -171.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.268 1.889 . . . . 0.0 111.673 173.215 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG21 HD11 ' A' ' 30' ' ' ILE . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG12 ' A' ' 70' ' ' VAL . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.413 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.46 HG21 HD21 ' A' ' 56' ' ' LEU . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.407 HD11 HG21 ' A' ' 5' ' ' VAL . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.634 HD11 HG11 ' B' ' 695' ' ' VAL . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 26' ' ' VAL . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.436 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.448 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -119.97 18.31 12.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.569 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.3 mm? 64.59 -24.68 0.08 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 169.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -65.68 167.31 9.36 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 120.279 1.4 . . . . 0.0 111.541 -174.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.52 39.86 0.18 Allowed Glycine 0 CA--C 1.529 0.93 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 -169.825 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -140.56 154.94 46.71 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.873 1.269 . . . . 0.0 108.096 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 53.3 mtt -79.05 44.57 0.57 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.667 1.187 . . . . 0.0 113.211 -172.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.54 52.22 0.51 Allowed Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.755 2.422 . . . . 0.0 107.415 169.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -74.84 -168.87 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.621 2.881 . . . . 0.0 111.024 -169.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -51.62 -16.88 0.71 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.851 1.66 . . . . 0.0 113.767 170.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.413 ' C ' ' HB ' ' A' ' 9' ' ' THR . 28.2 t70 -56.1 -8.0 0.41 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.763 2.025 . . . . 0.0 114.474 169.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.491 HG21 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm -134.69 136.79 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -172.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 691' ' ' LEU . . . . . 0.404 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 692' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 691' ' ' LEU . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.634 HG11 HD11 ' A' ' 44' ' ' ILE . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.416 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.569 ' CD1' HD21 ' A' ' 73' ' ' LEU . 41.4 m0 -61.87 -48.82 78.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -77.34 -30.79 54.11 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -63.4 -48.41 77.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.997 0.817 . . . . 0.0 110.305 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.4 p -70.42 -44.84 67.07 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.294 0 C-N-CA 125.621 1.581 . . . . 0.0 110.52 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.46 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.459 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.431 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.44 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.623 HD11 HG11 ' B' ' 695' ' ' VAL . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.45 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.427 HG12 HD21 ' A' ' 8' ' ' LEU . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.446 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -120.49 20.28 11.87 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.446 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.2 mp 56.87 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 120.122 3.378 . . . . 0.0 120.122 169.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.89 169.54 7.98 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 121.468 1.94 . . . . 0.0 111.542 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -175.69 38.46 0.1 Allowed Glycine 0 CA--C 1.532 1.149 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.331 0 N-CA-C 108.961 -1.656 . . . . 0.0 108.961 -173.193 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 120.91 0.172 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 31.6 m80 53.45 31.45 12.2 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.093 1.757 . . . . 0.0 113.21 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -161.25 141.11 10.64 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.413 2.285 . . . . 0.0 105.467 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -131.93 -85.13 0.0 OUTLIER Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.742 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.44 165.87 30.74 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 CA-C-N 123.048 2.124 . . . . 0.0 108.71 169.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.2 m -60.56 -11.3 6.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.034 1.334 . . . . 0.0 113.598 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.431 ' C ' ' HB ' ' A' ' 9' ' ' THR . 30.5 t70 -71.61 -4.15 25.48 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.908 2.083 . . . . 0.0 115.128 176.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.58 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.0 mm -130.98 148.67 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -169.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.623 HG11 HD11 ' A' ' 44' ' ' ILE . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.437 ' CB ' HD13 ' A' ' 73' ' ' LEU . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.58 ' CH2' HG21 ' B' ' 683' ' ' ILE . 48.2 m0 -59.41 -41.0 88.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -84.29 -24.75 29.74 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -65.78 -46.11 79.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.555 -0.735 . . . . 0.0 110.508 175.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.0 p -69.2 -47.72 64.06 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 C-N-CA 125.793 1.663 . . . . 0.0 111.632 173.261 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.455 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.4 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.406 HG13 ' HB3' ' A' ' 50' ' ' LEU . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 56' ' ' LEU . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' HB3' HG22 ' A' ' 70' ' ' VAL . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.551 HD11 HG11 ' B' ' 695' ' ' VAL . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.406 ' HB3' HG13 ' A' ' 23' ' ' ILE . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD21 HG21 ' A' ' 26' ' ' VAL . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.489 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 73' ' ' LEU . 7.8 ptm180 -104.58 10.86 34.8 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.574 HD12 ' C ' ' A' ' 72' ' ' ARG . 1.7 mp 66.26 -42.96 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.233 1.413 . . . . 0.0 114.019 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -164.74 166.15 20.14 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.505 1.522 . . . . 0.0 110.162 -171.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.6 26.21 3.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.679 1.133 . . . . 0.0 111.685 174.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 125.834 1.683 . . . . 0.0 109.048 176.421 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 113.804 0.282 . . . . 0.0 113.804 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -130.17 169.65 15.08 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.173 0.989 . . . . 0.0 108.638 -174.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -139.97 156.7 46.52 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 128.102 2.561 . . . . 0.0 104.376 171.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.259 62.9 m-85 -122.72 -91.47 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-O 115.659 -2.115 . . . . 0.0 107.609 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.29 161.4 46.13 Favored 'Trans proline' 0 C--N 1.352 0.738 0 CA-C-N 123.512 2.29 . . . . 0.0 108.621 169.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -58.78 -15.75 13.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.257 1.023 . . . . 0.0 112.673 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 682' ' ' ASP . . . . . 0.4 ' C ' ' HB ' ' A' ' 9' ' ' THR . 27.0 t70 -60.74 -6.95 1.96 Allowed 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 127.962 2.505 . . . . 0.0 115.538 174.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 683' ' ' ILE . . . . . 0.601 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -131.01 142.47 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 119.732 1.151 . . . . 0.0 109.124 -169.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 695' ' ' VAL . . . . . 0.551 HG11 HD11 ' A' ' 44' ' ' ILE . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 702' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 73' ' ' LEU . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 703' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.8 m0 -57.95 -47.03 84.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -78.53 -26.11 45.7 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -73.05 -43.26 62.2 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.825 0.739 . . . . 0.0 110.428 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 31.3 m -88.95 -25.55 22.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.882 1.273 . . . . 0.0 109.967 -169.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.26 0 C-N-CA 126.423 1.963 . . . . 0.0 111.862 172.586 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.537 HD12 HG23 ' B' ' 683' ' ' ILE . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.442 HG21 HD21 ' A' ' 56' ' ' LEU . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.555 HD11 HG11 ' B' ' 695' ' ' VAL . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.607 ' HB3' HD21 ' A' ' 50' ' ' LEU . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.607 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 26' ' ' VAL . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 8' ' ' LEU . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.653 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.555 HG11 HD11 ' A' ' 44' ' ' ILE . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.653 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.618 ' HB ' HG23 ' A' ' 9' ' ' THR . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.618 HG23 ' HB ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD11 HG11 ' B' ' 695' ' ' VAL . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.614 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.614 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.518 ' CG ' HD22 ' A' ' 50' ' ' LEU . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 . . . . . 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 8' ' ' LEU . 2.1 mm . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 44' ' ' ILE . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.455 ' CH2' HG21 ' B' ' 683' ' ' ILE . 46.7 m0 . . . . . 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.456 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.435 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.412 HG13 ' HB3' ' A' ' 50' ' ' LEU . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.548 HG21 HD21 ' A' ' 56' ' ' LEU . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG3' HD11 ' A' ' 13' ' ' ILE . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.637 HD11 HG11 ' B' ' 695' ' ' VAL . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 44' ' ' ILE . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.412 ' HB3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.548 HD21 HG21 ' A' ' 26' ' ' VAL . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.447 HG11 HD12 ' A' ' 44' ' ' ILE . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.54 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.637 HG11 HD11 ' A' ' 44' ' ' ILE . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.54 ' CH2' HG21 ' B' ' 683' ' ' ILE . 44.7 m0 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' B' ' 687' ' ' VAL . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.574 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.512 HD11 HG11 ' B' ' 695' ' ' VAL . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.611 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.503 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.693 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm . . . . . 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . 0.485 HG22 ' HE2' ' A' ' 6' ' ' LYS . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 44' ' ' ILE . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.693 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.4 m0 . . . . . 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.427 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 HG12 ' A' ' 70' ' ' VAL . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.421 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HG3' HD11 ' A' ' 13' ' ' ILE . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.596 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.528 ' CG ' HD22 ' A' ' 50' ' ' LEU . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.475 HG12 HD21 ' A' ' 8' ' ' LEU . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.523 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.523 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.1 m0 . . . . . 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.468 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.487 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.447 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HG3' HD11 ' A' ' 13' ' ' ILE . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.503 HD11 HG11 ' B' ' 695' ' ' VAL . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 45' ' ' PHE . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.525 ' CG ' HD22 ' A' ' 50' ' ' LEU . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.498 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.541 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.541 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.418 ' HE2' HG22 ' B' ' 687' ' ' VAL . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.437 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG3' HD11 ' A' ' 13' ' ' ILE . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 43' ' ' LEU . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HG11 ' B' ' 695' ' ' VAL . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB3' HD21 ' A' ' 50' ' ' LEU . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.421 HG12 HD21 ' A' ' 8' ' ' LEU . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.543 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.7 mm . . . . . 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . 0.418 HG22 ' HE2' ' A' ' 6' ' ' LYS . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 44' ' ' ILE . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.518 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.434 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.469 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.419 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.457 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.602 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' B' ' 692' ' ' PRO . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.517 ' CG ' HD22 ' A' ' 50' ' ' LEU . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.457 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.61 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . 0.407 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . 0.42 ' HD3' ' HA2' ' A' ' 47' ' ' GLY . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.61 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 . . . . . 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.44 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 HD21 ' A' ' 56' ' ' LEU . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.44 ' HG3' HD11 ' A' ' 13' ' ' ILE . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.429 HD21 HG21 ' A' ' 26' ' ' VAL . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.469 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.519 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' B' ' 683' ' ' ILE . 45.8 m0 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.446 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.511 HD21 HG12 ' A' ' 70' ' ' VAL . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.505 HG21 HD21 ' A' ' 56' ' ' LEU . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HG3' HD11 ' A' ' 13' ' ' ILE . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.44 HD11 HG11 ' B' ' 695' ' ' VAL . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.464 ' HB3' HD11 ' A' ' 50' ' ' LEU . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.464 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 26' ' ' VAL . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.43 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.511 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.44 HG11 HD11 ' A' ' 44' ' ' ILE . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.0 m0 . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG2' HD21 ' A' ' 15' ' ' LEU . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.43 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.607 ' HB3' HG23 ' B' ' 683' ' ' ILE . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD21 ' CG2' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.402 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.411 HG23 ' O ' ' A' ' 48' ' ' LYS . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.607 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.1 mm . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . 0.801 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . 0.801 ' HD2' HD13 ' B' ' 691' ' ' LEU . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.504 ' HB ' HD12 ' B' ' 691' ' ' LEU . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.464 ' CH2' HG21 ' B' ' 683' ' ' ILE . 37.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.469 HD11 HG11 ' B' ' 695' ' ' VAL . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.52 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.499 ' CG ' HD22 ' A' ' 50' ' ' LEU . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.415 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.5 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.469 HG11 HD11 ' A' ' 44' ' ' ILE . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.5 ' CH2' HG21 ' B' ' 683' ' ' ILE . 42.6 m0 . . . . . 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 70' ' ' VAL . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.494 HG21 HD21 ' A' ' 56' ' ' LEU . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.597 HD11 HG11 ' B' ' 695' ' ' VAL . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 50' ' ' LEU . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' ILE . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.409 HD12 ' CD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 HG21 ' A' ' 26' ' ' VAL . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.409 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.507 HG12 HD21 ' A' ' 8' ' ' LEU . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.424 HG23 ' CB ' ' A' ' 8' ' ' LEU . 1.2 mm . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.597 HG11 HD11 ' A' ' 44' ' ' ILE . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . . . . . . . . . 34.6 m0 . . . . . 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.419 ' HD3' HG13 ' B' ' 687' ' ' VAL . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.407 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.546 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.516 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm . . . . . 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . 0.419 HG13 ' HD3' ' A' ' 6' ' ' LYS . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.516 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.8 m0 . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HD3' HG13 ' B' ' 687' ' ' VAL . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.444 ' OG1' HG22 ' A' ' 9' ' ' THR . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 70' ' ' VAL . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.444 HG22 ' OG1' ' A' ' 7' ' ' THR . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.528 HD11 HG11 ' B' ' 695' ' ' VAL . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.636 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.636 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.464 HG12 HD21 ' A' ' 8' ' ' LEU . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.635 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm . . . . . 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . 0.425 HG13 ' HD3' ' A' ' 6' ' ' LYS . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . 0.736 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . 0.736 ' HD2' HD13 ' B' ' 691' ' ' LEU . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.528 HG11 HD11 ' A' ' 44' ' ' ILE . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' B' ' 683' ' ' ILE . 52.9 m0 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.44 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.454 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.407 ' HG3' HD21 ' A' ' 69' ' ' LEU . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 HG11 ' B' ' 695' ' ' VAL . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.67 ' HB3' HD21 ' A' ' 50' ' ' LEU . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.576 ' CG ' HD22 ' A' ' 50' ' ' LEU . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.492 HG12 HD21 ' A' ' 8' ' ' LEU . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.649 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.448 HG11 HD11 ' A' ' 44' ' ' ILE . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.649 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.8 m0 . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.4 HG13 ' HB3' ' A' ' 50' ' ' LEU . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.518 HG21 HD21 ' A' ' 56' ' ' LEU . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' A' ' 13' ' ' ILE . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.452 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.521 HD11 HG11 ' B' ' 695' ' ' VAL . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.475 ' HB3' HD11 ' A' ' 50' ' ' LEU . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.518 HD21 HG21 ' A' ' 26' ' ' VAL . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CD1' HD12 ' A' ' 50' ' ' LEU . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 8' ' ' LEU . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 . . . . . 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.687 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.5 mm . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . 0.402 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 44' ' ' ILE . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.687 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.3 m0 . . . . . 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG21 HD11 ' A' ' 30' ' ' ILE . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG12 ' A' ' 70' ' ' VAL . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.46 HG21 HD21 ' A' ' 56' ' ' LEU . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.407 HD11 HG21 ' A' ' 5' ' ' VAL . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.634 HD11 HG11 ' B' ' 695' ' ' VAL . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 26' ' ' VAL . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.436 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.448 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.491 HG21 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . 0.404 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 691' ' ' LEU . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.634 HG11 HD11 ' A' ' 44' ' ' ILE . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.491 ' CH2' HG21 ' B' ' 683' ' ' ILE . 41.4 m0 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.46 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.459 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.44 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.623 HD11 HG11 ' B' ' 695' ' ' VAL . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.45 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.427 HG12 HD21 ' A' ' 8' ' ' LEU . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.58 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.0 mm . . . . . 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.623 HG11 HD11 ' A' ' 44' ' ' ILE . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.58 ' CH2' HG21 ' B' ' 683' ' ' ILE . 48.2 m0 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.455 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.406 HG13 ' HB3' ' A' ' 50' ' ' LEU . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 56' ' ' LEU . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' HB3' HG22 ' A' ' 70' ' ' VAL . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.551 HD11 HG11 ' B' ' 695' ' ' VAL . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.406 ' HB3' HG13 ' A' ' 23' ' ' ILE . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD21 HG21 ' A' ' 26' ' ' VAL . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.489 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 683' ' ' ILE . . . . . 0.601 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 695' ' ' VAL . . . . . 0.551 HG11 HD11 ' A' ' 44' ' ' ILE . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 703' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.8 m0 . . . . . 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 ptt? . . . . . 0 N--CA 1.498 1.953 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -132.6 153.89 50.59 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 124.386 1.074 . . . . 0.0 110.183 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pt -142.03 155.35 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -108.39 99.23 8.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.075 1.35 . . . . 0.0 108.251 -169.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.46 103.73 13.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -71.03 121.39 18.13 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.2 p -82.36 159.28 23.09 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-O 123.766 1.746 . . . . 0.0 110.854 169.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.537 HD12 HG23 ' B' ' 683' ' ' ILE . 0.2 OUTLIER -60.9 -15.03 26.34 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 111.929 -2.396 . . . . 0.0 114.279 -177.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.6 t -84.23 -6.79 59.44 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 120.701 1.591 . . . . 0.0 110.837 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.91 36.67 5.7 Favored Glycine 0 CA--C 1.525 0.659 0 CA-C-O 119.006 -0.885 . . . . 0.0 110.922 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.71 158.09 21.36 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.62 113.23 13.94 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 120.501 1.5 . . . . 0.0 108.261 169.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.53 114.09 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.5 m -79.73 142.12 35.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.32 150.82 41.29 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -107.71 124.22 49.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 123.717 0.636 . . . . 0.0 109.29 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 m -148.76 -168.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 127.266 2.226 . . . . 0.0 110.015 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.13 154.78 65.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 126.15 1.78 . . . . 0.0 106.331 175.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -53.56 -32.2 62.75 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 121.947 1.765 . . . . 0.0 112.822 169.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 p -87.35 2.63 49.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.263 1.425 . . . . 0.0 110.904 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -74.36 135.83 42.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.8 p -74.67 149.11 40.07 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.732 1.253 . . . . 0.0 111.527 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -49.25 -40.54 13.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 113.615 -1.629 . . . . 0.0 110.979 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.97 -46.01 85.81 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 120.225 1.375 . . . . 0.0 110.81 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -75.2 -30.35 60.6 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 122.043 -0.41 . . . . 0.0 110.911 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.442 HG21 HD21 ' A' ' 56' ' ' LEU . 46.6 t -60.35 -53.99 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 121.293 -0.879 . . . . 0.0 108.717 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -56.93 -34.8 68.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.527 1.058 . . . . 0.0 111.53 177.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.95 76.88 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.149 0.886 . . . . 0.0 110.479 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -68.71 -33.54 74.11 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 121.325 -0.859 . . . . 0.0 109.44 172.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.1 mm -62.42 -39.98 86.32 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.084 0 O-C-N 120.216 -1.553 . . . . 0.0 110.11 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -58.71 -37.86 77.05 Favored 'General case' 0 C--N 1.319 -0.733 0 O-C-N 120.336 -1.478 . . . . 0.0 109.729 175.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -65.05 -39.42 93.26 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.072 0.396 . . . . 0.0 111.153 173.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.79 -27.12 19.09 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -169.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -122.68 -34.38 3.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 126.333 1.853 . . . . 0.0 112.431 -169.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.74 7.28 45.17 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 124.478 1.037 . . . . 0.0 112.817 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -95.72 128.65 37.0 Favored Pre-proline 0 C--N 1.342 0.258 0 CA-C-N 118.717 1.259 . . . . 0.0 107.825 -169.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -66.78 144.46 71.43 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.694 2.263 . . . . 0.0 111.559 176.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.07 -33.8 72.2 Favored 'Trans proline' 0 CA--C 1.512 -0.615 0 C-N-CA 122.42 2.08 . . . . 0.0 114.064 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -66.72 -24.19 66.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.98 0.419 . . . . 0.0 111.246 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -98.6 -1.97 39.65 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.209 1.404 . . . . 0.0 110.724 -175.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.284 8.9 tt0 -117.04 139.35 50.8 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.296 -1.502 . . . . 0.0 107.309 -168.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -117.44 160.89 20.45 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.298 1.408 . . . . 0.0 110.282 173.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.6 tp -127.59 128.32 45.36 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 123.928 0.891 . . . . 0.0 108.951 -176.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.555 HD11 HG11 ' B' ' 695' ' ' VAL . 3.4 mp -114.65 153.19 16.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 125.927 1.691 . . . . 0.0 108.749 172.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.607 ' HB3' HD21 ' A' ' 50' ' ' LEU . 34.3 t80 -143.18 126.16 16.28 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 169.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.58 39.25 29.84 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 169.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 75.74 30.1 58.4 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.924 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -143.61 156.89 44.71 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 126.387 1.875 . . . . 0.0 105.969 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -113.23 146.7 38.88 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 125.059 1.344 . . . . 0.0 107.456 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.607 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.2 mt -107.8 165.78 11.19 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.478 0.711 . . . . 0.0 109.417 -176.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -124.33 152.41 43.14 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.236 0.614 . . . . 0.0 109.499 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -58.1 -34.83 70.62 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.301 1.44 . . . . 0.0 112.092 -169.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.5 2.32 82.77 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-O 118.826 -0.985 . . . . 0.0 114.207 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -106.58 176.83 5.04 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 119.166 1.483 . . . . 0.0 109.368 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.1 p -131.13 167.93 18.3 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 118.744 0.702 . . . . 0.0 109.486 -174.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 26' ' ' VAL . 41.7 mt -57.35 -46.47 83.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.872 177.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -58.84 -33.2 70.15 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.087 1.355 . . . . 0.0 112.458 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.22 -29.91 70.99 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.722 1.146 . . . . 0.0 110.264 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -97.7 7.1 47.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.571 1.548 . . . . 0.0 112.283 176.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 60.39 19.54 9.17 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.459 2.304 . . . . 0.0 113.367 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 53.3 mt -64.53 143.03 16.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -124.74 -169.24 1.94 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -61.06 166.02 3.85 Favored 'General case' 0 CA--C 1.514 -0.427 0 O-C-N 121.157 -0.964 . . . . 0.0 111.537 171.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.262 8.0 pt-20 40.02 46.21 1.75 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.106 2.163 . . . . 0.0 110.939 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -120.32 152.29 38.04 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.177 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.3 m -104.72 144.86 31.16 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 123.266 0.626 . . . . 0.0 109.924 -169.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -128.59 172.8 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.845 2.458 . . . . 0.0 109.184 -178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 3.7 m80 -129.81 138.51 51.06 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.17 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.483 ' O ' HD23 ' A' ' 8' ' ' LEU . 2.6 tm? -118.21 124.05 46.96 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 119.689 1.131 . . . . 0.0 109.112 -175.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -120.09 163.97 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 118.921 0.782 . . . . 0.0 109.383 173.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.83 132.69 40.82 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.904 -2.258 . . . . 0.0 104.904 169.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.5 24.83 8.47 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 123.494 0.718 . . . . 0.0 112.532 177.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mm? 70.2 -57.24 0.57 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.96 1.704 . . . . 0.0 113.507 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -161.64 -178.29 6.46 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 120.03 1.287 . . . . 0.0 110.853 -169.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -165.19 -46.27 0.02 OUTLIER Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 169.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 N-CA-C 108.652 -1.779 . . . . 0.0 108.652 174.309 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 111.669 -0.572 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -134.63 12.65 3.74 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.339 1.056 . . . . 0.0 112.468 -171.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -160.67 167.87 26.07 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.814 1.246 . . . . 0.0 109.215 177.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -142.97 -75.94 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 116.471 -1.728 . . . . 0.0 107.815 171.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.46 168.3 24.04 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 122.376 1.884 . . . . 0.0 109.211 169.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -59.53 -17.04 28.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.177 0.991 . . . . 0.0 112.691 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -66.61 -0.1 2.64 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.119 1.368 . . . . 0.0 114.288 174.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.653 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm -130.08 143.35 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 120.101 1.319 . . . . 0.0 110.023 -175.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -149.01 141.32 15.05 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 127.555 2.342 . . . . 0.0 107.062 -173.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.31 -30.86 92.35 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.899 2.399 . . . . 0.0 113.82 -172.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.51 -54.24 31.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 120.137 1.335 . . . . 0.0 109.928 -171.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.8 t -69.27 -39.32 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 O-C-N 121.411 -0.806 . . . . 0.0 109.631 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -61.71 -19.31 62.26 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 124.808 1.243 . . . . 0.0 111.656 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -88.35 -35.32 17.24 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.589 1.086 . . . . 0.0 111.286 172.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.94 -29.56 68.48 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.82 0.848 . . . . 0.0 110.83 169.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.6 tp -57.55 146.72 63.51 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.687 2.395 . . . . 0.0 112.518 177.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -63.03 143.9 91.74 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.288 2.659 . . . . 0.0 111.25 170.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -63.8 -40.29 96.28 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.171 -175.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.42 83.31 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.381 0.991 . . . . 0.0 111.44 -174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.555 HG11 HD11 ' A' ' 44' ' ' ILE . 15.0 t -71.8 -39.04 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 175.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -56.56 -42.26 78.25 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.559 1.072 . . . . 0.0 109.749 174.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.64 -45.76 73.84 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 125.475 1.51 . . . . 0.0 110.45 178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.25 -53.96 52.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 176.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -60.35 4.0 Favored 'General case' 0 C--O 1.212 -0.909 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.591 -169.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -60.09 -39.49 86.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.212 0.914 . . . . 0.0 111.44 -176.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.58 -45.77 67.89 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.674 0.67 . . . . 0.0 110.212 -176.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -67.81 -40.34 83.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.521 0.729 . . . . 0.0 111.311 176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.653 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 -60.35 -46.89 88.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.1 -42.44 98.52 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 125.064 1.345 . . . . 0.0 110.775 175.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -66.32 -49.7 66.12 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.692 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.4 p -73.27 -26.34 61.05 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 118.769 0.713 . . . . 0.0 110.488 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.297 0 C-N-CA 128.091 2.757 . . . . 0.0 112.651 177.113 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ptt? . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 119.442 -0.313 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -130.17 158.61 39.22 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 121.214 -0.929 . . . . 0.0 110.255 171.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.13 161.98 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -116.55 96.8 5.68 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 124.785 1.234 . . . . 0.0 108.014 -169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -86.48 98.8 7.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.8 tttp -66.72 125.99 27.58 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.618 ' HB ' HG23 ' A' ' 9' ' ' THR . 69.3 p -81.72 163.44 22.44 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.884 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.536 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.4 mt -62.8 -16.13 56.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.233 -1.387 . . . . 0.0 108.808 167.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.618 HG23 ' HB ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -71.35 -14.95 62.36 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.022 1.283 . . . . 0.0 109.273 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.72 24.27 36.29 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-O 118.53 -1.15 . . . . 0.0 111.206 -169.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -119.85 121.69 39.65 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 119.027 1.414 . . . . 0.0 107.235 -177.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.94 113.14 25.3 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 175.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.33 114.94 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 175.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.9 m -79.71 142.9 35.04 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 172.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.36 158.7 43.61 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.117 172.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -100.68 130.94 46.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.047 0.927 . . . . 0.0 108.736 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.5 m -146.45 -171.22 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 126.95 2.1 . . . . 0.0 108.76 -169.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -132.42 157.34 78.53 Favored Pre-proline 0 C--N 1.327 -0.401 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 169.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.81 -35.95 80.96 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 CA-C-N 120.979 1.385 . . . . 0.0 111.715 173.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.5 m -92.11 10.0 31.12 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 121.088 -1.007 . . . . 0.0 110.121 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -70.42 135.24 48.56 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -75.99 148.7 37.9 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 121.853 0.835 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.05 -43.09 20.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 117.556 -1.212 . . . . 0.0 110.753 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.14 -46.34 82.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.451 1.478 . . . . 0.0 110.788 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -74.6 -32.68 62.43 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.99 -0.443 . . . . 0.0 110.725 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.3 t -61.33 -52.37 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -56.63 -35.96 68.94 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.663 1.12 . . . . 0.0 111.196 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.89 -34.34 77.57 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.694 1.134 . . . . 0.0 110.737 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.2 mttm -67.52 -33.69 75.59 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 121.036 -1.04 . . . . 0.0 109.419 171.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mm -64.45 -38.72 83.31 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.304 0 O-C-N 120.821 -1.174 . . . . 0.0 109.867 173.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.4 -37.3 75.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 120.754 1.615 . . . . 0.0 109.767 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.81 -31.3 72.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.03 0.377 . . . . 0.0 111.638 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -96.37 -32.56 12.3 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -174.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.74 -37.74 5.07 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.009 2.124 . . . . 0.0 110.702 -169.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.73 15.74 30.74 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.773 1.177 . . . . 0.0 112.484 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.2 mt -108.97 126.49 29.24 Favored Pre-proline 0 C--N 1.344 0.344 0 CA-C-N 118.758 1.279 . . . . 0.0 107.571 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -66.33 149.38 85.02 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.965 2.443 . . . . 0.0 111.694 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -63.38 -34.39 66.35 Favored 'Trans proline' 0 CA--C 1.51 -0.685 0 C-N-CA 122.04 1.827 . . . . 0.0 113.714 -172.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -24.16 65.98 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.881 -177.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -97.06 -6.94 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.988 1.315 . . . . 0.0 110.992 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.255 9.1 tt0 -112.67 137.13 51.4 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 126.007 1.723 . . . . 0.0 106.662 -169.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -110.88 156.76 20.69 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.106 1.321 . . . . 0.0 109.19 172.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 tp -125.25 126.81 45.75 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD11 HG11 ' B' ' 695' ' ' VAL . 63.7 mt -119.53 156.2 21.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 176.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.614 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -143.19 120.81 11.79 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 174.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.61 38.7 5.92 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 169.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 17.27 57.12 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.021 1.296 . . . . 0.0 113.408 174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -136.05 132.79 36.66 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 118.966 1.383 . . . . 0.0 109.447 172.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -67.98 150.72 48.12 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 124.73 1.212 . . . . 0.0 109.232 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.614 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.6 mt -111.26 157.5 20.06 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -117.09 155.76 28.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.451 1.023 . . . . 0.0 110.075 176.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -57.64 -35.32 70.35 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.971 1.308 . . . . 0.0 112.241 -168.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.11 10.73 52.32 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.368 0.985 . . . . 0.0 114.1 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.69 177.46 4.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 109.235 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.9 p -131.28 167.5 19.12 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -173.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.85 -39.92 90.96 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.146 0.498 . . . . 0.0 109.897 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.5 p -61.73 -32.78 73.03 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 126.012 1.725 . . . . 0.0 112.991 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.08 -18.52 64.46 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.065 0.848 . . . . 0.0 111.119 176.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.518 ' CG ' HD22 ' A' ' 50' ' ' LEU . 78.4 m-85 -114.47 10.75 16.99 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.832 1.653 . . . . 0.0 111.32 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 57.63 20.35 6.21 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.562 2.345 . . . . 0.0 113.193 176.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mt -65.18 146.18 13.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -127.97 -170.11 2.18 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.842 1.257 . . . . 0.0 107.898 176.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -59.32 162.09 4.99 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.996 -1.065 . . . . 0.0 111.121 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 39.86 50.7 2.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 112.774 -2.012 . . . . 0.0 109.54 176.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -123.71 152.2 42.34 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 113.123 -1.853 . . . . 0.0 108.207 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.9 m -103.29 145.49 29.88 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 123.432 0.693 . . . . 0.0 109.635 -169.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -130.25 174.47 9.8 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.985 2.514 . . . . 0.0 108.705 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -126.86 132.37 50.96 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.91 0.884 . . . . 0.0 109.092 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.411 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -104.66 137.52 42.35 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 116.94 -1.505 . . . . 0.0 107.329 174.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.5 m -136.07 165.23 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 169.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -103.42 122.16 44.29 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.491 ' C ' HD12 ' A' ' 73' ' ' LEU . 1.6 ptt180 -109.77 17.78 20.87 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 112.795 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.491 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.5 mp 65.7 -43.8 0.37 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.504 1.922 . . . . 0.0 115.337 172.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 ptt85 -158.55 172.56 18.08 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 120.619 1.554 . . . . 0.0 110.472 -169.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.1 34.87 1.89 Allowed Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.292 0.949 . . . . 0.0 110.988 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.507 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.47 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 112.347 -0.301 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.66 21.5 2.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 111.518 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.08 172.93 17.31 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.679 1.592 . . . . 0.0 108.506 -178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.257 51.6 t80 49.28 60.21 15.85 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 123.958 0.903 . . . . 0.0 110.494 -177.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -65.19 -175.46 0.4 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 123.908 3.072 . . . . 0.0 111.115 170.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -52.93 -14.65 0.6 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.952 1.701 . . . . 0.0 113.64 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 9' ' ' THR . 10.8 t70 -57.45 -14.77 5.37 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.652 1.181 . . . . 0.0 112.372 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.536 HG23 ' HB3' ' A' ' 8' ' ' LEU . 2.1 mm -136.88 152.17 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 -177.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -149.46 132.05 7.99 Favored Pre-proline 0 C--O 1.241 0.655 0 C-N-CA 125.037 1.335 . . . . 0.0 108.416 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -46.74 -44.35 22.04 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.996 3.131 . . . . 0.0 114.976 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -62.27 -48.14 81.25 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.4 1.454 . . . . 0.0 110.312 -171.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -67.0 -41.91 87.98 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.182 0 CA-C-O 122.375 1.083 . . . . 0.0 109.718 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -67.16 -18.64 65.37 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.849 1.66 . . . . 0.0 111.368 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -90.33 -29.36 18.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.463 1.505 . . . . 0.0 111.872 170.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -61.57 -28.85 69.63 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.319 1.057 . . . . 0.0 110.304 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -62.86 152.89 81.72 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 128.207 2.603 . . . . 0.0 112.759 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.01 154.71 72.09 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.607 2.871 . . . . 0.0 110.848 171.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -67.13 -45.78 76.08 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.757 0.823 . . . . 0.0 110.875 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.15 -36.95 77.96 Favored 'General case' 0 N--CA 1.461 0.084 0 O-C-N 121.497 -0.752 . . . . 0.0 112.126 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.605 HG11 HD11 ' A' ' 44' ' ' ILE . 3.1 t -74.19 -33.66 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 119.489 -0.885 . . . . 0.0 109.305 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -57.58 -43.06 84.32 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.582 1.083 . . . . 0.0 109.476 170.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.11 -47.57 61.92 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.256 1.022 . . . . 0.0 110.95 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -54.44 46.46 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.28 -63.45 1.26 Allowed 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 113.065 -1.879 . . . . 0.0 108.932 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.44 -38.94 85.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.097 0.862 . . . . 0.0 112.174 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.3 -48.19 62.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.439 0.563 . . . . 0.0 109.986 -175.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.403 ' HB3' HD13 ' A' ' 73' ' ' LEU . 36.2 mm-40 -60.49 -48.38 82.03 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.01 172.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.455 ' CH2' HG21 ' B' ' 683' ' ' ILE . 46.7 m0 -57.76 -47.6 82.04 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.178 0.899 . . . . 0.0 108.799 -170.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -78.8 -27.68 44.48 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.636 -0.665 . . . . 0.0 112.698 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 -72.34 -46.83 53.83 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 119.069 0.85 . . . . 0.0 110.486 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 40.6 m -82.98 -37.99 23.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 124.932 1.293 . . . . 0.0 109.269 -169.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.297 -1.28 . . . . 0.0 110.591 -177.032 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptt? . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.73 154.19 49.65 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.012 -1.055 . . . . 0.0 109.328 175.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -142.21 155.31 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -108.52 99.81 9.15 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.929 1.292 . . . . 0.0 109.025 -169.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.4 t -87.15 104.42 14.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -69.51 124.74 24.7 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 171.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.4 p -79.47 163.67 24.56 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.524 169.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.456 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.6 mt -61.17 -18.92 60.66 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 116.559 -1.686 . . . . 0.0 112.041 177.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.413 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -76.1 -14.06 60.19 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 121.555 1.98 . . . . 0.0 109.533 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.36 36.9 7.28 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-O 118.777 -1.013 . . . . 0.0 110.999 -170.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -116.42 120.31 38.4 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 171.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.71 116.59 27.94 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.435 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -101.53 113.75 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 175.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.7 m -77.39 143.93 38.3 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.09 150.65 38.47 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 123.32 0.648 . . . . 0.0 109.392 176.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -106.38 123.16 47.64 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.663 0.602 . . . . 0.0 109.424 -173.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.37 -171.86 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 127.182 2.193 . . . . 0.0 108.876 -170.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -121.2 159.37 49.96 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 125.757 1.623 . . . . 0.0 106.815 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -53.01 -36.54 76.28 Favored 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 121.637 1.558 . . . . 0.0 111.733 170.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.18 9.34 36.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.197 -0.939 . . . . 0.0 109.941 -174.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -72.42 138.51 47.19 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.8 p -76.08 148.98 37.53 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 122.127 0.965 . . . . 0.0 110.981 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.412 HG13 ' HB3' ' A' ' 50' ' ' LEU . 5.9 mm -48.64 -41.65 12.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.541 169.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.96 -43.94 86.74 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 120.287 1.403 . . . . 0.0 110.836 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -76.34 -30.13 57.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 122.076 -0.39 . . . . 0.0 110.99 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.548 HG21 HD21 ' A' ' 56' ' ' LEU . 59.5 t -62.35 -54.21 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 170.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -56.2 -33.26 65.14 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.014 -1.054 . . . . 0.0 111.329 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.41 -34.41 77.9 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.413 1.46 . . . . 0.0 110.87 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -68.89 -28.24 66.51 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.786 -1.196 . . . . 0.0 109.982 172.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mm -67.69 -41.66 85.65 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.18 0 O-C-N 120.772 -1.205 . . . . 0.0 109.623 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.18 -38.29 73.42 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.829 1.649 . . . . 0.0 110.031 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -62.88 -34.77 78.09 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.975 0.352 . . . . 0.0 111.004 175.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG3' HD11 ' A' ' 13' ' ' ILE . 26.4 mmtm -97.74 -31.16 12.39 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -171.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -116.93 -31.0 5.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.514 1.926 . . . . 0.0 112.268 -168.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.2 10.49 51.39 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.641 1.115 . . . . 0.0 112.45 174.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.2 mt -100.58 126.59 35.17 Favored Pre-proline 0 C--N 1.342 0.261 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -66.61 146.36 79.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.56 2.173 . . . . 0.0 111.098 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.77 -36.89 71.43 Favored 'Trans proline' 0 CA--C 1.509 -0.749 0 C-N-CA 122.331 2.021 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -77.03 -18.11 58.35 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.458 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -90.8 0.46 57.45 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.634 0.774 . . . . 0.0 110.794 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.257 9.1 tt0 -117.83 141.9 47.91 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 126.395 1.878 . . . . 0.0 107.025 -170.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.55 157.01 25.96 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.125 1.33 . . . . 0.0 109.137 170.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 tp -128.11 128.18 44.4 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.637 HD11 HG11 ' B' ' 695' ' ' VAL . 69.3 mt -123.32 153.64 28.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 -177.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -143.6 122.34 12.62 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.48 39.46 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 170.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.4 15.4 62.18 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.08 -1.418 . . . . 0.0 113.792 174.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 44' ' ' ILE . 1.9 ptpt -125.25 164.76 19.62 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 118.945 1.373 . . . . 0.0 108.693 169.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -115.43 140.45 49.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.412 ' HB3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.91 167.98 10.17 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.0 -176.504 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.77 153.52 39.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.373 0.533 . . . . 0.0 110.768 174.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -58.79 -35.05 72.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.642 1.177 . . . . 0.0 112.506 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.11 18.03 29.64 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 124.623 1.106 . . . . 0.0 113.641 -177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -122.1 178.63 4.83 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 125.095 1.358 . . . . 0.0 109.277 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.8 p -131.62 166.65 20.96 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 118.753 0.706 . . . . 0.0 109.3 -172.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.548 HD21 HG21 ' A' ' 26' ' ' VAL . 42.9 mt -59.3 -40.37 85.97 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.319 0.58 . . . . 0.0 110.054 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.2 p -61.42 -33.16 73.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.551 1.54 . . . . 0.0 113.346 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.37 -26.8 68.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 119.209 0.913 . . . . 0.0 110.357 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -105.27 8.58 33.93 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.505 1.522 . . . . 0.0 112.008 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.28 17.54 8.34 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 127.49 2.316 . . . . 0.0 113.612 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.4 mt -63.86 146.66 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 169.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -127.28 -171.19 2.36 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.918 1.287 . . . . 0.0 107.81 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -59.52 162.52 4.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 121.254 -0.903 . . . . 0.0 111.413 171.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.0 pt-20 41.03 47.01 2.6 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.916 2.087 . . . . 0.0 110.331 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.1 m -121.46 156.21 33.25 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.712 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.3 m -105.73 148.2 27.71 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 123.353 0.661 . . . . 0.0 109.539 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.24 177.01 7.91 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.835 2.454 . . . . 0.0 108.641 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.83 140.04 51.09 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 175.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.9 OUTLIER -109.06 133.17 53.35 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 172.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.447 HG11 HD12 ' A' ' 44' ' ' ILE . 2.6 m -128.42 162.69 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -103.15 124.35 48.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.691 ' C ' HD13 ' A' ' 73' ' ' LEU . 2.5 ppt_? -108.28 24.76 12.53 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 124.28 1.032 . . . . 0.0 112.434 177.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.691 HD13 ' C ' ' A' ' 72' ' ' ARG 0.284 0.0 OUTLIER 46.46 -16.1 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 168.044 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -143.85 148.67 35.82 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 124.074 3.125 . . . . 0.0 110.739 174.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -89.83 65.8 2.92 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 169.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 -177.736 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 CA-C-O 121.361 0.423 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -140.66 163.5 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.454 1.502 . . . . 0.0 108.941 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.5 mmt -68.28 158.67 32.89 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.014 0.526 . . . . 0.0 109.839 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 89.5 t80 46.36 57.26 16.74 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 123.697 0.799 . . . . 0.0 111.221 -169.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -72.71 -172.34 0.93 Allowed 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.563 2.842 . . . . 0.0 110.391 173.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.8 m -60.4 11.72 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.94 2.096 . . . . 0.0 114.465 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.413 ' C ' ' HB ' ' A' ' 9' ' ' THR . 30.2 t70 -84.63 -3.58 58.57 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.282 1.833 . . . . 0.0 112.444 169.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.54 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -135.73 142.35 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.962 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -170.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -146.04 136.96 12.51 Favored Pre-proline 0 C--O 1.237 0.435 0 C-N-CA 127.546 2.338 . . . . 0.0 107.228 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -47.66 -37.93 28.1 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.454 2.769 . . . . 0.0 115.281 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.82 -56.54 14.68 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 119.525 1.057 . . . . 0.0 109.909 -170.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 5.5 t -65.28 -32.29 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-O 122.412 1.101 . . . . 0.0 110.276 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -68.23 -31.92 71.76 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.568 -175.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -78.59 -22.88 46.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.341 1.057 . . . . 0.0 112.143 169.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.32 4.19 0.77 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.424 2.29 . . . . 0.0 113.689 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -132.89 166.3 30.25 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 126.046 1.738 . . . . 0.0 110.541 -174.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -64.9 141.9 73.16 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.733 2.288 . . . . 0.0 111.755 -170.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -54.16 -35.82 62.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.26 0.624 . . . . 0.0 111.707 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -61.6 -50.01 74.29 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.453 1.101 . . . . 0.0 111.983 -177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.637 HG11 HD11 ' A' ' 44' ' ' ILE . 31.9 t -71.99 -30.92 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -62.22 -43.16 99.46 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.59 1.087 . . . . 0.0 109.81 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.35 -41.8 73.0 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.105 0.866 . . . . 0.0 109.905 175.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.76 -55.48 29.61 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 176.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -64.1 1.07 Allowed 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.72 1.608 . . . . 0.0 109.695 -172.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.0 -40.5 93.77 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.257 -171.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.49 -47.08 67.97 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -175.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.504 ' HB3' HD21 ' A' ' 73' ' ' LEU . 7.3 mm-40 -63.92 -41.66 97.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 118.329 -0.843 . . . . 0.0 111.352 173.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.54 ' CH2' HG21 ' B' ' 683' ' ' ILE . 44.7 m0 -60.6 -49.98 75.35 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -173.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -31.53 66.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.423 -0.799 . . . . 0.0 112.328 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.1 mtm180 -67.78 -50.03 59.25 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.832 1.196 . . . . 0.0 111.181 176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.1 p -83.55 -21.18 32.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.658 0.383 . . . . 0.0 111.517 -171.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 126.245 1.879 . . . . 0.0 111.958 174.672 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 118.97 -0.538 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -127.9 156.72 42.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.222 0.919 . . . . 0.0 110.728 174.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.7 pt -142.66 161.0 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -114.65 97.71 6.44 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.765 1.226 . . . . 0.0 108.637 -171.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.24 101.49 11.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' B' ' 687' ' ' VAL . 31.8 tttt -68.63 123.1 19.96 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.6 p -83.18 165.99 19.0 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.41 172.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.574 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.0 mt -60.85 -20.93 62.66 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.559 177.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.9 t -75.21 -13.65 60.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 121.386 1.903 . . . . 0.0 109.814 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.83 35.72 9.83 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-O 118.729 -1.039 . . . . 0.0 110.884 -170.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -112.05 116.36 30.41 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 172.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.99 113.83 21.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 175.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.08 112.09 30.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 m -76.67 141.62 40.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 171.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.45 160.44 41.08 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 119.15 -0.452 . . . . 0.0 110.027 172.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.68 130.73 48.11 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.073 0.94 . . . . 0.0 108.877 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.3 m -145.41 -171.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 127.336 2.254 . . . . 0.0 108.48 -169.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -132.32 158.04 76.66 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -53.5 -36.98 82.03 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 121.313 1.342 . . . . 0.0 111.508 171.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.39 9.63 33.38 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.283 -0.885 . . . . 0.0 110.208 -175.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -69.93 135.31 49.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 p -76.88 149.88 36.08 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.883 0.849 . . . . 0.0 110.543 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -51.01 -41.86 23.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.979 169.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.58 -48.53 79.12 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.401 1.455 . . . . 0.0 110.705 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -73.74 -33.64 64.4 Favored 'General case' 0 C--O 1.227 -0.112 0 O-C-N 121.977 -0.452 . . . . 0.0 110.387 -174.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 t -58.68 -52.11 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 124.125 0.97 . . . . 0.0 108.998 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -56.85 -36.6 70.21 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.05 1.296 . . . . 0.0 111.39 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.08 -34.08 77.24 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.01 0.823 . . . . 0.0 110.808 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.54 -35.97 81.53 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.248 -0.908 . . . . 0.0 109.295 171.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.1 mm -64.13 -37.07 78.91 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.235 0 O-C-N 120.584 -1.323 . . . . 0.0 110.266 175.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -57.19 -38.2 73.32 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 120.601 1.546 . . . . 0.0 109.616 172.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.41 -27.9 68.2 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.369 174.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -107.99 -13.43 14.96 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -125.13 -39.59 2.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 126.775 2.03 . . . . 0.0 111.747 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.86 12.02 33.25 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 124.179 0.895 . . . . 0.0 112.475 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -104.06 127.78 28.54 Favored Pre-proline 0 C--N 1.344 0.345 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -170.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -66.13 151.99 82.32 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.555 2.17 . . . . 0.0 111.477 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.3 -33.87 46.68 Favored 'Trans proline' 0 CA--C 1.506 -0.884 0 C-N-CA 121.775 1.65 . . . . 0.0 113.728 -172.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.24 -20.44 62.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.585 0.707 . . . . 0.0 111.257 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -91.99 -5.77 52.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.339 1.056 . . . . 0.0 111.576 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.287 8.8 tt0 -120.51 144.99 47.73 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 126.496 1.918 . . . . 0.0 108.383 -169.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.2 ttt180 -119.41 161.44 20.5 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.628 1.104 . . . . 0.0 109.225 169.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -125.04 128.64 48.84 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.512 HD11 HG11 ' B' ' 695' ' ' VAL . 57.0 mt -120.94 154.07 24.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.611 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.8 t80 -141.33 121.11 13.48 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.74 36.06 3.55 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 169.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.5 9.33 59.03 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 118.391 -1.227 . . . . 0.0 113.611 174.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -130.96 133.28 45.67 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 119.469 1.634 . . . . 0.0 109.881 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -63.35 150.35 43.61 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 125.215 1.406 . . . . 0.0 108.987 175.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.6 mt -110.93 157.75 19.52 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.9 pt-20 -116.67 153.65 31.95 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.031 0.832 . . . . 0.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -58.05 -32.99 68.54 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.524 1.129 . . . . 0.0 113.36 -169.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 10.05 58.17 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 124.186 0.898 . . . . 0.0 113.156 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -117.35 176.4 5.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 124.759 1.224 . . . . 0.0 109.194 -174.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.2 p -130.92 167.19 19.4 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.2 mt -60.27 -39.71 87.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.751 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.4 p -62.52 -32.02 72.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 125.469 1.507 . . . . 0.0 113.662 174.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -60.82 -27.15 67.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.146 0.884 . . . . 0.0 110.06 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.1 m-85 -105.72 7.94 32.75 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.431 1.492 . . . . 0.0 112.295 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.08 17.01 8.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 127.217 2.207 . . . . 0.0 113.678 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.89 145.16 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 169.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -126.47 -168.62 1.89 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.08 1.352 . . . . 0.0 107.585 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -62.25 166.94 4.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 120.671 -1.268 . . . . 0.0 111.024 172.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.6 pt-20 39.38 46.71 1.4 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.919 2.088 . . . . 0.0 110.604 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -122.19 153.49 38.73 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.102 -174.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.4 m -103.73 147.05 27.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 123.332 0.653 . . . . 0.0 109.972 -169.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.97 174.92 9.68 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 127.89 2.476 . . . . 0.0 109.048 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -126.85 136.21 52.04 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.877 0.871 . . . . 0.0 109.096 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.3 tm? -108.15 136.79 47.24 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 117.074 -1.441 . . . . 0.0 107.328 175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.503 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.3 m -134.08 163.79 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 16.2 tp -91.74 133.13 35.88 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 169.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.513 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -120.5 14.51 11.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 169.42 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 72' ' ' ARG . 3.3 mp 68.19 -59.52 0.44 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.2 1.8 . . . . 0.0 113.698 171.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -169.15 166.96 10.67 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.205 1.402 . . . . 0.0 110.609 -171.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -145.73 19.52 1.82 Allowed Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.103 1.335 . . . . 0.0 111.635 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.278 0 C-N-CA 126.992 2.234 . . . . 0.0 107.782 175.467 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.998 0.221 . . . . 0.0 112.643 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -71.49 -31.59 67.28 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 122.144 -0.621 . . . . 0.0 111.537 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 42.8 ttp -80.89 144.02 32.27 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 169.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.33 0.1 OUTLIER 36.66 53.33 2.46 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.821 2.048 . . . . 0.0 115.273 178.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -61.01 -176.67 0.16 Allowed 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.17 2.58 . . . . 0.0 109.47 169.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -49.2 -23.07 1.17 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.585 1.154 . . . . 0.0 113.963 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.6 -20.55 8.22 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.332 1.853 . . . . 0.0 115.238 171.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.693 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm -133.8 140.93 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.985 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -173.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -137.13 132.24 18.02 Favored Pre-proline 0 C--O 1.239 0.5 0 C-N-CA 125.227 1.411 . . . . 0.0 109.003 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -46.17 -38.23 19.33 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.46 3.44 . . . . 0.0 115.124 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 12.6 tm0? -62.63 -51.94 65.33 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.432 1.469 . . . . 0.0 109.131 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . 0.485 HG22 ' HE2' ' A' ' 6' ' ' LYS . 11.0 t -68.76 -42.5 82.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 122.452 1.12 . . . . 0.0 109.976 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -65.43 -19.66 66.04 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.311 1.444 . . . . 0.0 111.316 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -87.86 -29.73 20.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.935 1.294 . . . . 0.0 111.536 170.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -61.27 -14.78 28.99 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.477 1.911 . . . . 0.0 111.752 169.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.8 tp -87.81 155.44 53.07 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.135 2.574 . . . . 0.0 111.727 -169.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -63.49 151.87 82.88 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.361 2.707 . . . . 0.0 110.509 169.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -70.51 -41.28 72.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.714 0.688 . . . . 0.0 110.588 -178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -65.31 -38.95 91.76 Favored 'General case' 0 C--O 1.234 0.253 0 O-C-N 121.528 -0.733 . . . . 0.0 111.762 -171.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 44' ' ' ILE . 2.8 t -72.95 -35.41 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.971 176.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -57.0 -42.71 80.79 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.472 1.487 . . . . 0.0 110.12 171.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.06 -47.08 68.73 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.742 1.217 . . . . 0.0 110.259 177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.38 -54.15 50.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.6 mp -57.34 -63.57 1.18 Allowed 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.998 1.719 . . . . 0.0 108.694 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -58.3 -42.09 85.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 119.148 0.886 . . . . 0.0 111.745 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.53 69.65 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.627 0.649 . . . . 0.0 110.233 -175.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 73' ' ' LEU . 14.4 mm-40 -63.26 -43.22 98.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.101 -0.476 . . . . 0.0 110.64 175.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.693 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.4 m0 -60.24 -36.58 78.09 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.139 0.576 . . . . 0.0 109.973 -172.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -86.83 -28.42 22.92 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.0 mtp85 -63.4 -45.76 89.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.07 0.85 . . . . 0.0 111.049 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 26.3 p -69.75 -51.78 31.17 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.327 0 C-N-CA 126.096 1.808 . . . . 0.0 111.17 178.636 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptt? . . . . . 0 N--CA 1.5 2.071 0 CA-C-O 119.298 -0.382 . . . . 0.0 111.599 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -129.85 156.94 43.55 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 118.983 0.81 . . . . 0.0 109.925 172.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.3 pt -141.36 160.67 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.894 0.877 . . . . 0.0 109.046 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -114.46 97.97 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.609 1.164 . . . . 0.0 108.25 -170.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -87.08 102.78 12.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -67.06 128.1 35.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 170.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.427 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.1 p -82.94 163.24 21.18 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.958 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 HG12 ' A' ' 70' ' ' VAL . 10.1 mt -60.68 -18.09 51.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 116.032 -1.937 . . . . 0.0 112.08 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -76.14 -14.88 60.16 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 122.496 2.407 . . . . 0.0 110.166 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.05 35.41 7.65 Favored Glycine 0 C--N 1.339 0.73 0 CA-C-O 118.82 -0.989 . . . . 0.0 111.244 -169.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -118.29 123.65 45.9 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.08 116.51 27.41 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.421 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.71 114.94 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 172.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 m -79.77 142.91 34.94 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 172.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 159.09 43.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 119.143 -0.456 . . . . 0.0 109.873 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -101.29 131.23 47.42 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.0 m -146.44 -170.56 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 127.197 2.199 . . . . 0.0 108.328 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.23 158.5 75.12 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 169.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -53.66 -36.57 81.83 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 CA-C-N 120.846 1.338 . . . . 0.0 111.475 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -92.35 10.37 30.1 Favored 'General case' 0 CA--C 1.52 -0.192 0 O-C-N 120.977 -1.077 . . . . 0.0 110.092 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -70.71 135.38 48.24 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 169.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 p -77.32 148.83 35.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 122.072 0.939 . . . . 0.0 110.364 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.17 -42.41 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.487 170.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.35 -45.57 87.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.529 1.513 . . . . 0.0 110.823 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.36 -34.62 65.71 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.717 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.7 t -60.49 -52.35 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 124.241 1.016 . . . . 0.0 108.877 172.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -56.16 -35.52 67.28 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.904 1.229 . . . . 0.0 110.967 176.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.29 -34.27 77.05 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 119.917 1.235 . . . . 0.0 111.073 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -66.8 -33.31 75.33 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 120.921 -1.112 . . . . 0.0 109.74 171.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.6 mm -65.99 -38.97 83.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 O-C-N 120.954 -1.091 . . . . 0.0 109.936 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.43 -38.43 74.37 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 120.514 1.507 . . . . 0.0 109.444 172.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -66.49 -30.69 71.08 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.99 0.359 . . . . 0.0 111.085 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HG3' HD11 ' A' ' 13' ' ' ILE . 52.7 mmtt -95.19 -33.71 12.51 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.82 -34.25 4.86 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 126.454 1.901 . . . . 0.0 112.64 -168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.35 12.05 32.07 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 124.5 1.048 . . . . 0.0 113.093 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.6 mt -103.92 125.34 34.81 Favored Pre-proline 0 C--N 1.343 0.292 0 CA-C-O 117.798 -1.096 . . . . 0.0 108.311 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -66.82 149.67 83.33 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.704 2.269 . . . . 0.0 111.358 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.98 -34.56 47.15 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.653 1.568 . . . . 0.0 114.195 -169.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.24 -20.93 61.46 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.341 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -91.02 -3.36 57.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.614 1.166 . . . . 0.0 111.144 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.8 tt0 -119.88 142.94 48.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.334 2.253 . . . . 0.0 108.312 -169.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.5 ttt180 -116.3 158.83 22.79 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.578 1.081 . . . . 0.0 108.255 169.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 tp -125.01 127.56 47.18 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 58.2 mt -118.09 155.02 20.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.596 ' HB3' HD21 ' A' ' 50' ' ' LEU . 23.3 t80 -145.78 120.32 9.75 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 174.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 53.69 36.22 23.19 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.8 15.1 73.86 Favored Glycine 0 CA--C 1.531 1.094 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.218 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -130.85 118.22 20.45 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 125.866 1.666 . . . . 0.0 107.437 -176.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -62.82 148.09 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.189 -0.944 . . . . 0.0 108.688 173.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.0 mt -111.02 156.61 21.01 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.4 154.4 30.34 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.766 1.166 . . . . 0.0 109.719 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -56.95 -35.62 69.32 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.862 1.265 . . . . 0.0 112.543 -168.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.53 8.0 55.86 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.45 1.024 . . . . 0.0 114.079 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -116.85 177.42 4.71 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 118.56 1.18 . . . . 0.0 109.538 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.5 p -131.29 167.2 19.63 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 118.657 0.662 . . . . 0.0 109.311 -172.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.0 -39.43 89.64 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.156 0.503 . . . . 0.0 109.931 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -62.23 -32.51 73.2 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 113.1 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.12 -19.52 65.32 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.159 0.89 . . . . 0.0 110.9 176.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.528 ' CG ' HD22 ' A' ' 50' ' ' LEU . 69.8 m-85 -114.19 10.01 17.22 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.883 1.673 . . . . 0.0 112.246 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.65 18.51 8.52 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 127.243 2.217 . . . . 0.0 113.757 175.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.1 mt -64.95 144.14 15.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -127.23 -169.86 2.12 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -59.1 163.79 3.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.348 1.059 . . . . 0.0 111.16 172.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.27 9.0 pt-20 40.15 47.44 2.06 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.99 2.116 . . . . 0.0 110.434 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.0 m -121.61 153.58 37.89 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.763 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.2 m -104.21 148.07 26.74 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 123.198 0.599 . . . . 0.0 109.545 -169.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.19 175.6 9.25 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 128.074 2.549 . . . . 0.0 109.146 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -128.03 132.98 49.08 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.91 0.884 . . . . 0.0 109.123 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -104.43 135.24 46.23 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 174.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.475 HG12 HD21 ' A' ' 8' ' ' LEU . 1.6 m -133.94 165.92 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.494 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 20.8 tp -91.49 140.68 29.52 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.185 -1.784 . . . . 0.0 106.185 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.7 23.71 5.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 169.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 71' ' ' LEU . 1.4 mm? 70.38 -56.66 0.59 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.173 1.789 . . . . 0.0 113.618 169.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -162.66 160.34 25.52 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 120.291 1.405 . . . . 0.0 111.385 -172.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.66 31.79 1.76 Allowed Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.071 1.319 . . . . 0.0 110.474 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.028 0 C-N-CA 127.348 2.404 . . . . 0.0 107.522 178.251 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.489 -0.645 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -133.54 169.96 16.22 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.945 1.298 . . . . 0.0 109.847 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -61.43 156.91 18.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.5 1.12 . . . . 0.0 110.887 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 93.3 t80 46.17 58.42 16.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 124.202 1.001 . . . . 0.0 111.229 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.61 -172.66 0.98 Allowed 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.213 2.609 . . . . 0.0 110.318 171.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -55.63 -14.69 2.31 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.218 1.407 . . . . 0.0 113.625 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -57.64 -7.31 0.64 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.916 1.687 . . . . 0.0 114.773 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.523 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -133.19 137.95 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 -174.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -138.97 133.75 16.58 Favored Pre-proline 0 C--O 1.24 0.598 0 C-N-CA 126.621 1.968 . . . . 0.0 108.132 -175.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -43.89 -42.85 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 124.529 3.486 . . . . 0.0 115.902 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -67.62 -45.79 74.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 120.116 1.325 . . . . 0.0 110.536 -170.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 25.4 t -68.76 -42.23 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-O 122.327 1.061 . . . . 0.0 109.56 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -60.02 -18.02 43.14 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 124.859 1.264 . . . . 0.0 111.287 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -90.87 -29.63 17.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.361 1.464 . . . . 0.0 112.164 170.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -59.29 -28.22 66.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.755 1.622 . . . . 0.0 109.989 169.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 6.2 tp -69.42 153.49 95.76 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 128.649 2.779 . . . . 0.0 112.407 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.48 150.39 80.4 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.626 2.884 . . . . 0.0 110.39 173.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -70.13 -38.39 75.54 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.635 -0.666 . . . . 0.0 111.361 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.84 -40.55 72.34 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.769 -0.582 . . . . 0.0 111.324 -174.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -72.39 -33.85 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.448 -0.783 . . . . 0.0 108.898 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -58.34 -41.15 83.97 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.2 0.909 . . . . 0.0 109.989 169.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.36 -45.69 69.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.566 0.746 . . . . 0.0 110.844 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.84 -55.21 35.15 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -61.15 2.8 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 125.479 1.511 . . . . 0.0 110.154 -169.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -57.96 -41.5 83.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 119.491 1.041 . . . . 0.0 111.356 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.87 -47.15 63.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.356 0.526 . . . . 0.0 110.273 -177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.12 -37.44 85.73 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.172 177.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.523 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.1 m0 -62.29 -48.53 79.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -175.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.54 -29.72 61.49 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.677 -0.678 . . . . 0.0 112.577 178.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -66.03 -53.27 40.72 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.258 0.936 . . . . 0.0 110.597 176.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 76.9 p -81.01 -25.47 37.2 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 123.172 0.295 . . . . 0.0 110.82 -170.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.248 0 C-N-CA 126.273 1.892 . . . . 0.0 112.393 172.831 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 ptt? . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 118.962 -0.542 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -130.6 158.54 39.73 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.148 0.886 . . . . 0.0 110.816 172.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -141.87 162.13 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.98 0.912 . . . . 0.0 109.255 175.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -116.38 97.2 5.9 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.929 1.292 . . . . 0.0 108.673 -169.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.4 t -87.69 103.01 13.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 106.623 -1.621 . . . . 0.0 106.623 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -67.94 126.02 28.15 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.468 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 68.6 p -82.0 163.49 22.09 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.026 169.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.487 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.98 -18.59 58.26 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 116.361 -1.78 . . . . 0.0 112.034 176.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.0 t -76.5 -13.45 60.1 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 122.119 2.236 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.19 35.96 7.84 Favored Glycine 0 C--N 1.34 0.769 0 CA-C-O 118.687 -1.063 . . . . 0.0 111.448 -169.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -117.37 122.71 44.6 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 172.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.01 114.49 27.06 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.447 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.84 112.66 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 m -76.68 143.37 40.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 171.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 158.59 43.8 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-O 119.09 -0.481 . . . . 0.0 109.98 173.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -99.93 131.16 46.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 124.221 0.951 . . . . 0.0 108.536 -178.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 m -145.64 -171.81 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 127.281 2.233 . . . . 0.0 108.396 -169.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -133.42 156.3 79.86 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -54.84 -31.03 70.92 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 121.494 1.462 . . . . 0.0 113.024 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -95.96 10.06 38.61 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 120.806 -1.184 . . . . 0.0 110.212 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -73.37 135.52 44.29 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 172.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -77.05 149.24 35.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.083 0.944 . . . . 0.0 111.13 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.42 -41.62 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.463 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -58.58 -45.25 89.46 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.46 1.482 . . . . 0.0 110.623 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -74.23 -32.65 63.07 Favored 'General case' 0 CA--C 1.528 0.115 0 O-C-N 122.102 -0.374 . . . . 0.0 110.697 -176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.58 -52.23 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 C-N-CA 123.933 0.893 . . . . 0.0 108.793 171.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 82.7 mttt -56.82 -34.57 67.84 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.764 1.165 . . . . 0.0 111.208 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.15 -35.04 79.42 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.91 1.232 . . . . 0.0 111.194 176.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -68.28 -31.6 71.17 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.746 -1.221 . . . . 0.0 110.167 171.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -66.57 -38.7 82.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 O-C-N 120.734 -1.229 . . . . 0.0 109.492 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -58.43 -38.3 77.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 121.017 1.735 . . . . 0.0 110.24 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -62.15 -33.66 74.9 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.039 0.381 . . . . 0.0 110.86 174.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HG3' HD11 ' A' ' 13' ' ' ILE . 25.1 mmtm -96.57 -33.74 11.7 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -172.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -114.96 -31.8 5.96 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 126.342 1.857 . . . . 0.0 112.67 -168.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.84 13.33 37.62 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 124.504 1.05 . . . . 0.0 112.897 173.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.9 mt -106.27 126.42 30.55 Favored Pre-proline 0 C--N 1.341 0.205 0 CA-C-O 117.9 -1.048 . . . . 0.0 108.359 -169.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -67.94 150.13 77.97 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.829 2.353 . . . . 0.0 111.839 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -63.61 -32.51 69.26 Favored 'Trans proline' 0 CA--C 1.513 -0.546 0 C-N-CA 122.33 2.02 . . . . 0.0 114.086 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -67.55 -25.94 66.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.673 0.749 . . . . 0.0 110.523 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -94.71 -6.93 42.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.764 1.226 . . . . 0.0 111.444 -177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.264 9.7 tt0 -113.84 139.66 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.564 1.546 . . . . 0.0 108.591 -168.243 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HB3' HG22 ' A' ' 70' ' ' VAL . 2.0 ttt180 -112.79 157.56 21.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.588 1.085 . . . . 0.0 108.977 170.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -126.18 127.18 45.31 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.503 HD11 HG11 ' B' ' 695' ' ' VAL . 94.0 mt -118.73 156.25 20.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.4 t80 -145.61 118.22 8.59 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 52.39 32.03 10.54 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 169.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.91 11.09 62.08 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.229 0.919 . . . . 0.0 113.613 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -123.76 118.13 26.49 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 126.198 1.799 . . . . 0.0 106.905 -176.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -63.55 146.74 53.09 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.006 -1.059 . . . . 0.0 108.224 170.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 45' ' ' PHE . 9.6 mt -108.99 158.82 17.35 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -118.5 154.73 32.05 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 119.314 0.961 . . . . 0.0 110.073 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -56.96 -35.67 69.4 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.963 1.305 . . . . 0.0 112.872 -168.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.76 9.76 54.64 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.364 0.983 . . . . 0.0 113.869 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -116.66 176.46 5.1 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 118.753 1.276 . . . . 0.0 109.344 -175.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.9 p -130.84 168.36 17.4 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 118.763 0.711 . . . . 0.0 109.505 -173.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -59.61 -43.52 93.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.584 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.5 m -62.62 -30.06 71.08 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.518 1.127 . . . . 0.0 112.763 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.87 -23.24 67.27 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 120.082 1.31 . . . . 0.0 111.028 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.525 ' CG ' HD22 ' A' ' 50' ' ' LEU . 73.3 m-85 -109.34 9.98 25.61 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.043 1.737 . . . . 0.0 112.37 176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 61.49 17.37 8.4 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.535 2.334 . . . . 0.0 113.753 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -64.02 143.77 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 169.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -126.72 -167.62 1.75 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.404 1.481 . . . . 0.0 107.61 174.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -62.42 164.58 7.11 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 120.925 -1.109 . . . . 0.0 110.711 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 41.25 48.24 3.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 109.21 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -121.46 151.68 39.96 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 113.585 -1.643 . . . . 0.0 108.076 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.5 m -102.26 146.77 27.53 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.187 0.595 . . . . 0.0 109.517 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -132.29 176.16 8.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 127.908 2.483 . . . . 0.0 108.704 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.4 m80 -128.53 134.06 48.57 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.887 0.875 . . . . 0.0 109.065 178.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -105.0 135.3 46.6 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 173.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.498 HG22 ' HB3' ' A' ' 42' ' ' ARG . 1.6 m -132.85 167.14 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 169.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -104.32 120.57 41.48 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 176.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.512 ' C ' HD12 ' A' ' 73' ' ' LEU . 10.8 ptm180 -109.68 15.01 23.11 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 118.538 -0.744 . . . . 0.0 112.714 174.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.512 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.2 mp 65.44 -50.05 0.37 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.985 1.714 . . . . 0.0 114.753 174.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -164.52 154.66 14.26 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.34 1.456 . . . . 0.0 109.403 -169.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.1 -26.45 73.78 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.581 0.628 . . . . 0.0 111.867 171.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.287 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 177.972 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 CA-C-O 120.96 0.2 . . . . 0.0 113.187 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -68.92 -23.88 64.22 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.869 0.868 . . . . 0.0 113.06 -175.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.6 mmt -134.21 170.68 15.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.484 1.513 . . . . 0.0 109.378 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 48.14 57.44 17.98 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 111.423 -169.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -72.01 -172.92 0.93 Allowed 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 123.247 2.632 . . . . 0.0 110.516 170.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.7 m -55.88 -14.04 2.19 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.286 1.434 . . . . 0.0 113.948 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.43 -6.41 0.68 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.006 1.722 . . . . 0.0 114.805 170.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.541 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.6 mm -132.76 137.77 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -175.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -141.96 135.14 14.19 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 126.235 1.814 . . . . 0.0 108.85 -174.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -45.34 -38.14 14.94 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.589 3.526 . . . . 0.0 115.725 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -58.96 -56.43 22.37 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.754 1.615 . . . . 0.0 109.32 -175.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 14.4 t -71.33 -40.58 73.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-O 122.064 0.935 . . . . 0.0 109.64 -174.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.22 -19.69 63.44 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.876 1.271 . . . . 0.0 111.388 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -91.59 -29.38 16.95 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.846 1.258 . . . . 0.0 111.774 170.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -58.63 -27.51 64.78 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.245 1.818 . . . . 0.0 110.327 169.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -68.57 154.81 94.03 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 128.735 2.814 . . . . 0.0 112.546 -175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.41 154.98 72.24 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.609 2.872 . . . . 0.0 110.837 170.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.32 -42.49 71.87 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.717 -0.614 . . . . 0.0 112.069 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.58 89.28 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.56 -0.713 . . . . 0.0 111.173 -170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 44' ' ' ILE . 2.4 t -73.13 -33.56 42.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -58.91 -44.66 91.33 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.85 1.205 . . . . 0.0 109.895 171.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -42.45 70.22 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.763 177.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -54.57 43.51 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 122.063 0.935 . . . . 0.0 108.876 176.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -62.97 1.48 Allowed 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.176 -1.829 . . . . 0.0 108.875 -169.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.32 -39.11 85.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.873 0.76 . . . . 0.0 112.159 -174.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.18 -50.38 54.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -176.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -60.92 -43.52 98.47 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.142 0.577 . . . . 0.0 110.794 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.541 ' CH2' HG21 ' B' ' 683' ' ' ILE . 49.6 m0 -60.78 -48.25 82.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -173.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -76.46 -32.31 58.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.611 -0.68 . . . . 0.0 112.336 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -64.26 -48.86 74.15 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.741 0.701 . . . . 0.0 110.431 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.7 p -78.7 -30.13 45.86 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.277 0.361 . . . . 0.0 110.957 -178.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.322 0 C-N-CA 126.985 2.231 . . . . 0.0 112.45 -177.769 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptt? . . . . . 0 N--CA 1.5 2.056 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -127.61 156.21 42.64 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.197 0.999 . . . . 0.0 109.702 174.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 pt -141.79 158.86 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -112.47 97.91 6.92 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.448 1.099 . . . . 0.0 108.554 -171.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.7 t -87.3 100.47 10.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.418 ' HE2' HG22 ' B' ' 687' ' ' VAL . 24.4 tttt -67.85 125.33 25.93 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 170.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 75.9 p -82.34 164.62 20.96 Favored 'General case' 0 N--CA 1.433 -1.306 0 C-N-CA 119.355 -0.938 . . . . 0.0 110.395 171.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -61.37 -20.84 63.46 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-O 116.265 -1.826 . . . . 0.0 111.963 174.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.405 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -75.43 -13.4 60.39 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 121.807 2.094 . . . . 0.0 109.921 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.15 36.09 8.49 Favored Glycine 0 C--N 1.341 0.827 0 CA-C-O 118.727 -1.041 . . . . 0.0 111.089 -171.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -113.72 117.67 32.18 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 171.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.45 116.64 23.89 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.437 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -102.52 112.85 37.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 173.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 m -77.34 143.37 38.82 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.76 158.47 43.78 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.132 172.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -100.9 131.6 46.71 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.081 0.944 . . . . 0.0 108.751 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -144.94 -170.81 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 126.886 2.074 . . . . 0.0 109.275 -169.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 33.1 mt-10 -129.85 155.51 80.4 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 169.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -54.71 -31.56 71.91 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 121.475 1.45 . . . . 0.0 112.713 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -92.5 7.82 41.47 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.622 -1.299 . . . . 0.0 110.253 -178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -71.84 133.82 45.72 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 173.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.4 p -75.3 148.29 39.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 122.015 0.912 . . . . 0.0 110.807 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -48.56 -41.66 11.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.832 169.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -58.01 -46.58 85.02 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.304 1.411 . . . . 0.0 110.912 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -74.86 -32.87 62.0 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 122.307 -0.246 . . . . 0.0 110.576 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 37.9 t -59.4 -53.25 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.928 0.891 . . . . 0.0 109.082 170.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -57.65 -34.71 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 119.733 1.151 . . . . 0.0 111.399 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.47 -34.24 76.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.453 1.024 . . . . 0.0 110.88 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.4 mttm -67.93 -33.02 73.87 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.034 -1.042 . . . . 0.0 109.913 170.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -64.68 -38.31 82.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 O-C-N 120.848 -1.157 . . . . 0.0 110.062 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.43 -36.83 74.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 121.089 1.768 . . . . 0.0 110.182 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.87 -33.18 74.73 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.063 0.392 . . . . 0.0 111.144 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG3' HD11 ' A' ' 13' ' ' ILE . 27.8 mmtm -95.4 -34.59 12.06 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -172.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -112.05 -35.92 5.52 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 126.673 1.989 . . . . 0.0 111.852 -169.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.86 13.9 35.83 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.499 1.047 . . . . 0.0 112.319 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -107.35 128.13 26.55 Favored Pre-proline 0 C--N 1.344 0.355 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -169.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.69 152.91 79.67 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.512 2.141 . . . . 0.0 111.643 178.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.66 -34.3 41.85 Favored 'Trans proline' 0 CA--C 1.508 -0.779 0 C-N-CA 121.864 1.709 . . . . 0.0 113.642 -173.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.41 -19.85 62.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.567 0.699 . . . . 0.0 110.743 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -95.91 -1.14 49.88 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 124.5 1.12 . . . . 0.0 111.453 -178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.265 9.0 tt0 -124.42 142.39 51.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 126.931 2.093 . . . . 0.0 107.022 -169.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.1 ttt180 -116.1 158.97 22.38 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 120.239 1.381 . . . . 0.0 108.779 171.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 43' ' ' LEU . 2.8 tp -125.68 130.43 51.55 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HG11 ' B' ' 695' ' ' VAL . 27.5 mt -122.98 152.13 27.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.545 ' HB3' HD21 ' A' ' 50' ' ' LEU . 30.1 t80 -144.12 119.54 10.3 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.963 -1.866 . . . . 0.0 105.963 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 51.18 33.1 8.89 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 172.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 94.61 0.44 64.62 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.442 1.02 . . . . 0.0 113.477 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -111.99 117.41 32.63 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 126.286 1.835 . . . . 0.0 106.561 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -67.66 145.61 54.63 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.84 -1.163 . . . . 0.0 108.19 170.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.2 mt -110.47 160.42 16.62 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 177.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -120.74 155.18 34.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -54.78 -38.39 67.21 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.898 1.679 . . . . 0.0 112.57 -168.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.14 -4.8 84.32 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 119.313 -0.715 . . . . 0.0 114.258 -175.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -99.9 177.95 4.96 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.066 1.433 . . . . 0.0 109.144 -175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.8 p -130.92 169.34 15.92 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.551 -0.718 . . . . 0.0 109.767 -175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.6 mt -59.87 -44.13 94.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.534 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.9 m -61.2 -30.15 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.732 1.213 . . . . 0.0 112.277 173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.06 -16.86 64.21 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 120.101 1.319 . . . . 0.0 110.969 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.9 m-85 -112.24 10.09 20.06 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.631 1.972 . . . . 0.0 112.046 175.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 58.44 20.18 7.2 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.08 2.152 . . . . 0.0 113.24 177.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mt -65.47 146.8 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 169.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -128.07 -169.58 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.737 1.215 . . . . 0.0 108.283 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.9 pttt -59.06 164.06 3.23 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.791 0.837 . . . . 0.0 111.041 170.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.271 9.1 pt-20 39.62 46.98 1.6 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 127.252 2.221 . . . . 0.0 110.355 178.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.3 m -120.93 151.7 39.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.733 -1.121 . . . . 0.0 108.321 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.3 m -103.8 146.05 29.2 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.24 173.98 10.51 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.754 2.422 . . . . 0.0 109.194 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -127.51 133.97 49.82 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.736 -0.649 . . . . 0.0 109.254 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.5 tm? -106.13 137.02 44.78 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.421 HG12 HD21 ' A' ' 8' ' ' LEU . 1.5 m -135.25 164.24 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 169.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.433 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 28.5 tp -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.26 21.2 3.72 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 170.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.576 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.5 mm? 59.47 -22.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 120.42 3.489 . . . . 0.0 120.42 168.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.03 171.4 6.89 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 121.48 1.946 . . . . 0.0 111.025 -175.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 174.48 -21.25 0.06 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.7 -0.625 . . . . 0.0 113.152 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 177.221 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.873 0 CA-C-O 121.26 0.367 . . . . 0.0 112.801 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -69.86 -20.8 63.39 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -143.24 160.09 41.12 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.984 0.913 . . . . 0.0 109.671 177.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.327 0.3 OUTLIER 50.77 63.84 9.21 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 124.224 1.009 . . . . 0.0 111.485 -178.152 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.53 -171.54 0.96 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.139 1.893 . . . . 0.0 107.43 168.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -58.89 4.49 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 115.367 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.405 ' C ' ' HB ' ' A' ' 9' ' ' THR . 26.4 t70 -84.45 -15.15 47.12 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.745 1.618 . . . . 0.0 113.571 170.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.543 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.7 mm -132.8 159.05 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -170.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -156.22 137.5 9.48 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 127.367 2.267 . . . . 0.0 106.329 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.07 -37.92 90.07 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.603 2.202 . . . . 0.0 113.382 -170.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.87 -48.08 80.54 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.033 1.288 . . . . 0.0 110.252 -173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . 0.418 HG22 ' HE2' ' A' ' 6' ' ' LYS . 14.3 t -64.97 -36.95 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 122.412 1.101 . . . . 0.0 110.579 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.75 -15.05 62.17 Favored 'General case' 0 N--CA 1.432 -1.356 0 C-N-CA 125.491 1.516 . . . . 0.0 110.9 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -93.04 -23.05 18.79 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.634 1.574 . . . . 0.0 110.384 169.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -70.29 7.56 0.99 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.184 2.194 . . . . 0.0 110.899 169.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.2 tp -117.11 152.49 48.97 Favored Pre-proline 0 N--CA 1.448 -0.566 0 C-N-CA 127.69 2.396 . . . . 0.0 112.474 -167.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.57 139.67 65.13 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 124.017 3.145 . . . . 0.0 111.286 174.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.32 -31.62 72.89 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.683 -0.636 . . . . 0.0 112.385 -177.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.15 -41.84 73.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 110.212 -173.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 44' ' ' ILE . 3.9 t -71.11 -37.44 67.01 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -57.07 -41.42 78.73 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.454 1.025 . . . . 0.0 110.179 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -44.74 78.21 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.859 0.864 . . . . 0.0 110.778 177.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.16 -53.81 52.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.134 0.969 . . . . 0.0 108.545 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mp -60.03 -61.61 2.48 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 125.688 1.595 . . . . 0.0 109.339 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.18 -38.86 80.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 119.353 0.979 . . . . 0.0 111.706 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.36 -50.03 43.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.549 0.613 . . . . 0.0 110.121 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -65.66 -35.78 81.77 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.854 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.576 ' CD1' HD21 ' A' ' 73' ' ' LEU . 49.6 m0 -60.87 -53.76 53.34 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 -176.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -72.45 -30.9 64.99 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.6 mtp85 -63.92 -50.64 67.92 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 118.658 0.663 . . . . 0.0 110.533 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 30.9 p -69.83 -42.62 73.38 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.393 0 C-N-CA 126.234 1.873 . . . . 0.0 113.12 171.393 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptt? . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 119.202 -0.428 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -125.02 156.5 38.05 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 123.757 0.823 . . . . 0.0 109.427 174.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.2 pt -141.49 159.86 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 171.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -113.43 97.46 6.48 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.645 1.178 . . . . 0.0 108.46 -171.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -87.02 106.93 16.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 O-C-N 119.841 -1.787 . . . . 0.0 106.446 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -72.61 127.33 32.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.434 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 71.7 p -83.85 157.52 21.98 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.655 169.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.469 ' HB3' HG23 ' B' ' 683' ' ' ILE . 6.3 mt -60.7 -15.6 30.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 117.003 -1.475 . . . . 0.0 112.325 -176.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.41 -14.47 60.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 121.461 1.937 . . . . 0.0 110.56 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.93 37.21 6.1 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -169.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -114.87 156.8 24.29 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 169.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -127.4 112.15 14.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 120.019 1.281 . . . . 0.0 108.318 175.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.29 115.74 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -80.15 142.18 35.0 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 173.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.67 159.86 42.13 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.091 173.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -102.03 131.97 48.16 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.058 0.933 . . . . 0.0 109.272 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.6 m -145.8 -170.68 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 C-N-CA 126.892 2.077 . . . . 0.0 109.442 -169.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -130.06 156.61 78.93 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -53.51 -36.56 80.54 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 CA-C-N 121.159 1.45 . . . . 0.0 111.44 170.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -93.1 11.05 29.05 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 120.973 -1.08 . . . . 0.0 110.178 -175.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -71.15 135.68 47.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 169.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.5 p -77.41 150.05 35.08 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.934 0.873 . . . . 0.0 110.295 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -50.82 -40.62 20.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.585 169.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -52.21 -52.43 52.32 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.107 1.321 . . . . 0.0 110.648 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -75.21 -31.31 60.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.919 -173.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.55 -51.83 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 C-N-CA 124.193 0.997 . . . . 0.0 108.684 173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -56.07 -37.93 69.98 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.739 1.154 . . . . 0.0 110.694 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.24 77.9 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.165 0.893 . . . . 0.0 110.162 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -67.5 -34.59 77.44 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 120.962 -1.086 . . . . 0.0 109.953 171.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.37 -37.33 79.7 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 120.393 -1.442 . . . . 0.0 109.901 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -58.16 -39.44 78.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 120.542 1.519 . . . . 0.0 110.09 172.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -62.38 -36.9 83.73 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 117.747 0.249 . . . . 0.0 111.321 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.13 -27.4 16.25 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -169.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -121.9 -35.74 3.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.199 1.799 . . . . 0.0 112.896 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.97 9.52 32.12 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.498 1.047 . . . . 0.0 113.029 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.3 mt -100.64 126.32 35.98 Favored Pre-proline 0 C--N 1.34 0.163 0 CA-C-N 118.662 1.231 . . . . 0.0 108.209 -169.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.68 148.98 83.87 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.505 2.136 . . . . 0.0 111.236 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.45 -33.21 58.39 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.987 1.791 . . . . 0.0 114.678 -170.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -73.46 -21.49 60.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.464 0.65 . . . . 0.0 110.478 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -88.03 -4.92 58.73 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.875 0.87 . . . . 0.0 111.242 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.419 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.291 9.8 tt0 -118.43 141.86 48.13 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.016 1.327 . . . . 0.0 109.684 -167.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.4 ttt180 -115.14 156.67 24.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.423 1.01 . . . . 0.0 108.645 169.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tp -123.5 131.57 53.67 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.514 HD11 HG11 ' B' ' 695' ' ' VAL . 45.3 mt -126.77 157.46 37.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 C-N-CA 125.601 1.561 . . . . 0.0 107.168 178.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.602 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.0 t80 -149.28 119.04 7.03 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.23 37.13 2.52 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 172.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' B' ' 692' ' ' PRO . . . 95.82 3.62 60.7 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.022 1.296 . . . . 0.0 114.718 176.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -112.75 122.14 46.79 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 125.953 1.701 . . . . 0.0 108.179 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.3 146.93 52.85 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 168.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 45' ' ' PHE . 3.0 mt -116.27 145.59 43.04 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -113.83 154.45 27.43 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 118.588 0.631 . . . . 0.0 109.602 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.03 -33.87 58.42 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.257 1.423 . . . . 0.0 113.481 -168.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.12 -4.38 83.4 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.053 0.835 . . . . 0.0 113.899 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -106.73 177.71 4.77 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 118.586 1.193 . . . . 0.0 109.182 -172.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.0 p -131.22 168.81 16.86 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.454 0.645 . . . . 0.0 109.686 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.27 -39.85 91.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.832 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 p -62.38 -31.82 72.55 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.168 1.787 . . . . 0.0 113.065 174.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.24 -18.42 65.29 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.361 0.982 . . . . 0.0 110.869 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.517 ' CG ' HD22 ' A' ' 50' ' ' LEU . 92.3 m-85 -113.97 9.98 17.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.11 1.764 . . . . 0.0 111.512 176.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.13 16.11 5.73 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.304 2.641 . . . . 0.0 114.056 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.45 144.67 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 125.562 1.545 . . . . 0.0 107.033 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -126.71 -168.7 1.91 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 ptmm? -56.92 163.76 1.84 Allowed 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.286 -0.884 . . . . 0.0 110.568 169.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.28 4.9 pt-20 42.73 44.51 3.79 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.777 2.031 . . . . 0.0 110.082 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -122.03 149.78 43.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.601 -1.181 . . . . 0.0 108.054 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 m -101.97 147.56 26.41 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.57 -178.95 5.0 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 127.868 2.467 . . . . 0.0 108.97 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.81 145.02 51.33 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.428 -0.795 . . . . 0.0 110.195 172.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -111.78 132.76 54.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 106.098 -1.815 . . . . 0.0 106.098 172.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.457 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.2 m -128.54 167.12 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 169.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -104.03 129.17 51.64 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.461 ' C ' HD12 ' A' ' 73' ' ' LEU . 4.4 ptt180 -115.28 15.58 16.91 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.5 mp 63.37 -20.24 0.06 Allowed 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 118.559 2.8 . . . . 0.0 118.559 170.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -65.15 169.68 5.31 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.461 1.937 . . . . 0.0 110.457 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.08 -27.35 0.18 Allowed Glycine 0 CA--C 1.532 1.13 0 O-C-N 121.473 -0.767 . . . . 0.0 112.313 172.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 C-N-CA 125.663 1.602 . . . . 0.0 109.398 178.547 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.751 0 CA-C-O 121.168 0.315 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -68.14 159.57 30.75 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 122.079 -0.659 . . . . 0.0 110.781 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -68.43 161.81 26.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.28 1.032 . . . . 0.0 110.158 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.3 t80 47.73 59.19 16.98 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.772 0.829 . . . . 0.0 110.927 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.36 -173.39 0.94 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.03 2.487 . . . . 0.0 110.419 169.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.5 m -56.23 -13.25 1.98 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.242 1.417 . . . . 0.0 114.032 172.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.57 -5.08 0.49 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.139 1.776 . . . . 0.0 114.809 171.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.61 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.9 mm -134.58 140.03 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.876 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 -173.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.69 137.48 13.11 Favored Pre-proline 0 CA--C 1.537 0.448 0 C-N-CA 127.011 2.124 . . . . 0.0 108.404 -176.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -45.05 -40.72 15.73 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 124.076 3.184 . . . . 0.0 116.318 -176.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -63.74 -55.72 21.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 120.558 1.526 . . . . 0.0 110.553 -170.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.12 -34.24 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.97 0.89 . . . . 0.0 109.779 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -67.88 -33.97 75.76 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.58 -174.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -76.42 -24.08 53.98 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.723 1.209 . . . . 0.0 112.408 170.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.27 -1.28 1.56 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.87 1.668 . . . . 0.0 114.315 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . 0.407 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.9 OUTLIER -125.99 167.8 15.87 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.849 1.66 . . . . 0.0 109.876 -173.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . 0.42 ' HD3' ' HA2' ' A' ' 47' ' ' GLY . 88.4 Cg_endo -65.19 141.56 69.8 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.394 2.063 . . . . 0.0 111.201 -169.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.88 -28.79 64.5 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.41 -0.806 . . . . 0.0 112.212 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.67 -47.86 68.27 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.577 1.151 . . . . 0.0 111.901 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.514 HG11 HD11 ' A' ' 44' ' ' ILE . 27.5 t -71.32 -34.89 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -58.83 -41.29 86.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 119.32 0.963 . . . . 0.0 109.806 173.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.32 -44.6 72.17 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.51 1.124 . . . . 0.0 110.023 177.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.09 -55.48 34.44 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.4 mp -57.01 -61.18 2.63 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.953 -170.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.8 -40.68 93.57 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 119.638 1.108 . . . . 0.0 112.118 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -67.7 -51.74 45.98 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.774 0.716 . . . . 0.0 109.603 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.49 -47.91 82.51 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.433 -0.794 . . . . 0.0 109.76 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.61 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.1 m0 -59.32 -49.06 79.28 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.402 1.001 . . . . 0.0 109.038 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -74.04 -28.62 61.5 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 121.465 -0.772 . . . . 0.0 112.565 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -72.87 -45.08 60.21 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.948 0.795 . . . . 0.0 110.116 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 32.9 m -87.52 -22.03 25.1 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.349 -169.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.303 0 C-N-CA 126.966 2.222 . . . . 0.0 112.758 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 ptt? . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -136.88 154.13 50.57 Favored 'General case' 0 C--N 1.342 0.275 0 O-C-N 121.42 -0.8 . . . . 0.0 110.139 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -142.31 156.21 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 175.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -109.61 100.04 9.14 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.076 1.35 . . . . 0.0 108.799 -169.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.16 104.78 14.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -70.11 125.65 27.38 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.0 p -84.95 158.23 20.6 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.945 0.879 . . . . 0.0 110.012 168.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.31 -16.33 44.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 116.65 -1.643 . . . . 0.0 112.595 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.8 t -75.06 -14.48 60.6 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 121.539 1.972 . . . . 0.0 110.279 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.66 37.15 5.89 Favored Glycine 0 C--N 1.338 0.663 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tmmm? -115.33 155.85 26.56 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.051 -2.203 . . . . 0.0 105.051 169.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.5 m -126.96 112.53 15.37 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 119.932 1.242 . . . . 0.0 107.966 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.44 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.17 112.31 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.2 m -75.32 143.32 42.97 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.91 151.36 39.71 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 123.22 0.608 . . . . 0.0 109.53 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -107.09 123.11 47.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.603 0.716 . . . . 0.0 109.371 -173.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.3 m -151.23 -173.09 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 127.498 2.319 . . . . 0.0 108.881 -170.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -121.24 156.92 56.98 Favored Pre-proline 0 C--N 1.325 -0.467 0 C-N-CA 125.528 1.531 . . . . 0.0 107.194 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -53.22 -32.23 59.36 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 121.878 1.719 . . . . 0.0 112.992 170.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.7 m -93.08 6.52 47.67 Favored 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 120.744 -1.223 . . . . 0.0 110.251 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -73.45 136.97 44.28 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.7 p -74.71 148.56 40.42 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 122.448 1.118 . . . . 0.0 111.478 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.0 mm -50.49 -40.34 18.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.487 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -57.04 -45.66 83.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.223 1.374 . . . . 0.0 110.732 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -74.81 -31.66 61.76 Favored 'General case' 0 C--N 1.333 -0.11 0 O-C-N 122.198 -0.314 . . . . 0.0 111.169 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.429 HG21 HD21 ' A' ' 56' ' ' LEU . 56.0 t -60.46 -53.48 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 O-C-N 121.142 -0.974 . . . . 0.0 108.766 170.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -55.95 -34.55 65.77 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.586 1.084 . . . . 0.0 111.264 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.917 1.235 . . . . 0.0 110.81 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -68.39 -28.73 67.36 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.056 -1.028 . . . . 0.0 110.399 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.7 mm -67.63 -41.1 85.25 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.179 0 O-C-N 120.654 -1.279 . . . . 0.0 109.708 170.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -57.62 -39.45 76.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 120.659 1.572 . . . . 0.0 109.985 172.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.61 -34.07 75.0 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.275 175.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.44 ' HG3' HD11 ' A' ' 13' ' ' ILE . 24.7 mmtm -98.52 -31.42 11.98 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -172.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -116.89 -31.76 5.32 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.742 1.617 . . . . 0.0 112.311 -168.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.1 10.89 44.34 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.831 1.205 . . . . 0.0 112.47 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.6 mt -100.81 126.98 33.5 Favored Pre-proline 0 C--N 1.34 0.162 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -169.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -69.37 148.73 68.27 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.577 2.185 . . . . 0.0 111.44 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.93 -33.12 64.66 Favored 'Trans proline' 0 CA--C 1.512 -0.611 0 C-N-CA 122.023 1.815 . . . . 0.0 114.386 -171.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.19 -25.52 64.37 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.704 -177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -91.3 -5.98 53.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.345 1.058 . . . . 0.0 111.154 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.271 9.7 tt0 -113.62 142.59 45.8 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.213 1.405 . . . . 0.0 108.201 -168.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -118.74 160.74 21.31 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.628 1.104 . . . . 0.0 109.3 169.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 tp -128.25 128.5 44.8 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.8 mp -115.86 159.75 15.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 108.285 172.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -144.86 125.28 13.91 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 172.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.0 37.96 5.68 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 169.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.77 18.98 49.75 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 118.594 -1.115 . . . . 0.0 112.912 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.8 pttt -145.9 136.06 23.76 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.509 1.655 . . . . 0.0 111.034 176.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -69.27 150.52 47.31 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 124.255 1.022 . . . . 0.0 109.791 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -102.95 175.77 5.37 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -132.0 156.42 46.25 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.92 0.782 . . . . 0.0 109.952 170.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -57.38 -36.65 71.53 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.379 1.472 . . . . 0.0 112.341 -169.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.74 14.33 42.85 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.416 1.008 . . . . 0.0 113.884 -175.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -120.08 177.58 4.94 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 125.18 1.392 . . . . 0.0 109.47 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.7 p -131.08 168.15 17.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 118.448 0.567 . . . . 0.0 109.773 -173.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.429 HD21 HG21 ' A' ' 26' ' ' VAL . 42.8 mt -57.59 -45.29 85.45 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.389 177.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -60.68 -31.37 70.62 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.063 1.345 . . . . 0.0 112.851 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.3 -31.65 72.28 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.997 1.271 . . . . 0.0 110.097 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.469 ' CG ' HD22 ' A' ' 50' ' ' LEU . 81.3 m-85 -98.33 7.48 46.16 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.2 1.4 . . . . 0.0 112.204 178.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.54 19.67 8.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.395 2.278 . . . . 0.0 113.546 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.04 143.38 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 169.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -125.19 -169.6 2.02 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 176.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -61.92 165.44 5.42 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 121.076 -1.015 . . . . 0.0 111.263 173.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.272 7.6 pt-20 40.92 46.26 2.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.976 2.11 . . . . 0.0 110.597 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.23 152.75 37.29 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.406 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -104.66 144.7 31.36 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 123.436 0.694 . . . . 0.0 109.765 -169.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 174.35 9.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 128.231 2.612 . . . . 0.0 109.095 -178.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.2 m80 -127.89 136.35 51.26 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.0 OUTLIER -108.49 134.48 51.21 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.6 m -129.94 166.05 28.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 O-C-N 124.207 0.942 . . . . 0.0 108.789 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -100.53 126.73 47.0 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.77 21.5 11.95 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 123.983 0.913 . . . . 0.0 112.457 178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 70.71 -63.55 0.41 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.895 1.278 . . . . 0.0 112.31 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -173.46 165.57 4.67 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 110.813 -169.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -93.61 -19.88 33.5 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.445 -0.642 . . . . 0.0 111.887 169.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 178.767 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -139.21 -27.39 0.81 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.64 1.576 . . . . 0.0 110.698 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 25.7 mmt -78.67 164.12 24.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.858 0.754 . . . . 0.0 110.167 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 90.3 t80 47.54 57.39 17.75 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.098 0.959 . . . . 0.0 110.963 -169.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -71.24 -173.36 0.91 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.391 2.727 . . . . 0.0 110.522 169.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.4 m -55.76 -12.94 1.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.614 1.566 . . . . 0.0 113.931 172.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -59.1 -4.08 0.46 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.125 1.77 . . . . 0.0 114.546 171.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.519 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.3 mm -135.92 139.06 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -172.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -145.57 136.6 12.49 Favored Pre-proline 0 N--CA 1.469 0.481 0 C-N-CA 126.896 2.078 . . . . 0.0 108.804 -175.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -42.94 -42.5 9.21 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 125.02 3.813 . . . . 0.0 116.817 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -66.82 -53.47 32.38 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.81 1.641 . . . . 0.0 110.414 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.46 -38.88 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.304 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -62.59 -37.86 87.89 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.043 -175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -72.92 -28.94 62.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.513 1.125 . . . . 0.0 112.485 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -63.35 -37.88 88.98 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.421 1.088 . . . . 0.0 112.355 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.24 163.06 71.3 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.683 0.793 . . . . 0.0 109.956 174.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -67.2 147.34 78.66 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.628 2.219 . . . . 0.0 112.526 -171.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 33.5 tp10 -57.17 -32.39 66.37 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.774 1.229 . . . . 0.0 111.562 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -71.1 -46.22 62.2 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.543 -0.723 . . . . 0.0 112.311 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.04 -32.93 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -59.78 -40.87 89.72 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.674 0.67 . . . . 0.0 109.836 171.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.95 -44.69 67.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.245 1.018 . . . . 0.0 110.489 176.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.53 -56.7 17.18 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 175.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -60.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.393 -169.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.1 pp -60.26 -40.64 91.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 119.673 1.124 . . . . 0.0 111.977 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.63 -47.55 63.02 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.327 0.512 . . . . 0.0 110.351 -177.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -66.51 -37.72 85.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.997 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' B' ' 683' ' ' ILE . 45.8 m0 -62.1 -45.78 92.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -175.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -77.37 -31.31 54.2 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.417 0.553 . . . . 0.0 112.418 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 9.5 mtp85 -62.24 -51.1 69.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.886 0.766 . . . . 0.0 110.694 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 27.2 p -72.13 -50.1 30.67 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.34 0 C-N-CA 125.439 1.495 . . . . 0.0 110.834 170.482 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.499 2.004 0 CA-C-O 119.552 -0.261 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -137.03 154.13 50.45 Favored 'General case' 0 CA--C 1.515 -0.379 0 O-C-N 121.272 -0.892 . . . . 0.0 109.712 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -141.46 154.0 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -108.29 99.97 9.32 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.799 1.24 . . . . 0.0 108.828 -169.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.42 102.84 12.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -68.58 126.79 30.77 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.446 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.45 163.89 22.44 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 119.601 -0.84 . . . . 0.0 109.593 169.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.511 HD21 HG12 ' A' ' 70' ' ' VAL . 10.9 mt -61.13 -18.86 60.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 116.421 -1.752 . . . . 0.0 111.86 176.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.435 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 9.9 t -78.12 -11.75 59.94 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 121.581 1.991 . . . . 0.0 109.672 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.51 35.03 8.84 Favored Glycine 0 C--N 1.342 0.887 0 CA-C-O 118.51 -1.161 . . . . 0.0 111.238 -171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -116.64 123.67 47.85 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.96 114.04 25.82 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.74 113.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 176.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 m -78.7 142.36 37.16 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -142.11 149.21 39.54 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -105.9 124.03 48.91 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 123.976 0.797 . . . . 0.0 109.082 -173.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.0 m -149.54 -169.1 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 126.865 2.066 . . . . 0.0 109.927 -169.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -123.73 155.95 65.73 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -53.71 -31.31 60.32 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.93 1.753 . . . . 0.0 112.727 169.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.3 m -95.31 9.61 39.19 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 120.737 -1.227 . . . . 0.0 109.985 -177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.34 137.57 42.91 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 p -76.37 147.71 37.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 122.166 0.984 . . . . 0.0 111.574 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.9 mm -48.54 -40.97 11.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.735 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -56.47 -45.6 80.82 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.943 1.247 . . . . 0.0 110.532 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -76.27 -28.14 56.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.373 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.505 HG21 HD21 ' A' ' 56' ' ' LEU . 69.1 t -64.55 -53.55 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 171.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -55.96 -34.1 65.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.181 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.25 -34.44 77.46 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 120.276 1.398 . . . . 0.0 110.962 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -68.82 -29.18 67.47 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.283 -0.886 . . . . 0.0 110.044 172.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 11.4 mm -66.99 -41.18 87.04 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.175 0 O-C-N 121.023 -1.048 . . . . 0.0 109.671 169.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -57.34 -39.21 75.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 120.765 1.621 . . . . 0.0 109.505 172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -65.04 -33.68 76.61 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 111.621 0.23 . . . . 0.0 111.621 177.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HG3' HD11 ' A' ' 13' ' ' ILE . 48.3 mmtt -95.56 -31.79 13.14 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -173.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -116.86 -33.44 4.78 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.45 1.9 . . . . 0.0 112.628 -168.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 101.45 9.37 44.28 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.438 1.018 . . . . 0.0 112.683 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.6 mt -99.42 127.49 34.25 Favored Pre-proline 0 C--N 1.34 0.192 0 CA-C-N 118.404 1.102 . . . . 0.0 108.559 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -69.93 150.45 67.17 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.524 2.15 . . . . 0.0 111.945 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.64 -32.49 57.78 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.493 2.129 . . . . 0.0 114.712 -172.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.61 -25.55 65.81 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.869 0.842 . . . . 0.0 110.856 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -93.34 -4.01 52.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.626 1.17 . . . . 0.0 110.699 -177.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.277 9.4 tt0 -118.32 132.97 56.26 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.375 1.47 . . . . 0.0 108.871 -168.201 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -106.33 152.04 24.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 169.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.6 tp -122.14 128.72 51.6 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.44 HD11 HG11 ' B' ' 695' ' ' VAL . 12.6 mt -121.23 150.1 24.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.464 ' HB3' HD11 ' A' ' 50' ' ' LEU . 38.1 t80 -141.28 123.76 15.86 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.68 38.97 4.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 170.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.86 6.66 58.01 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-N 114.507 -1.224 . . . . 0.0 113.756 172.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.76 147.44 51.3 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 119.552 1.676 . . . . 0.0 111.031 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.42 158.15 33.11 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.576 -0.702 . . . . 0.0 110.222 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.464 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -111.04 150.24 29.61 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 169.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -102.69 153.48 20.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.038 0.835 . . . . 0.0 109.448 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -57.24 -34.0 68.15 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.518 1.527 . . . . 0.0 113.123 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.29 3.86 60.99 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 123.978 0.799 . . . . 0.0 114.682 -175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -111.04 -178.24 3.41 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.755 1.277 . . . . 0.0 109.088 -173.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.0 p -131.23 169.61 15.71 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.468 0.652 . . . . 0.0 110.017 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.505 HD21 HG21 ' A' ' 26' ' ' VAL . 45.7 mt -59.11 -44.85 92.01 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.471 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.7 m -60.14 -31.53 70.16 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.103 1.361 . . . . 0.0 112.518 174.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.65 -24.69 67.66 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.537 1.062 . . . . 0.0 111.272 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.43 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.9 m-85 -106.47 10.17 31.44 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.777 1.631 . . . . 0.0 112.392 174.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.76 18.48 7.32 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 127.749 2.42 . . . . 0.0 113.929 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 mt -64.13 142.73 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 169.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -125.85 -167.85 1.76 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.151 1.38 . . . . 0.0 107.538 178.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 pttm -59.29 164.14 3.43 Favored 'General case' 0 CA--C 1.515 -0.369 0 O-C-N 120.936 -1.103 . . . . 0.0 110.805 170.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.258 3.1 pt-20 43.67 42.56 4.29 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.848 2.059 . . . . 0.0 110.53 175.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.1 m -117.12 150.46 38.65 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -104.3 142.18 34.99 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -127.6 173.19 10.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 128.182 2.593 . . . . 0.0 108.091 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -126.71 138.45 53.4 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -111.35 134.56 52.84 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 174.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.511 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -128.97 160.94 39.21 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 169.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -101.79 119.32 38.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.423 -2.066 . . . . 0.0 105.423 174.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.36 18.55 14.37 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.729 0.812 . . . . 0.0 112.232 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.548 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.2 mm? 69.31 -57.25 0.53 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.223 1.409 . . . . 0.0 113.422 169.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -164.8 158.85 17.91 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 120.243 1.383 . . . . 0.0 110.414 -169.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -137.83 3.16 3.12 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.659 1.123 . . . . 0.0 112.282 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.446 0 N-CA-C 108.816 -1.714 . . . . 0.0 108.816 176.907 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -141.48 163.94 31.58 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.763 1.225 . . . . 0.0 109.887 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 56.9 mtt -68.39 162.77 24.66 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.29 -92.95 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.295 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 169.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -71.84 161.6 44.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 CA-C-N 123.561 2.308 . . . . 0.0 108.043 168.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -62.39 -9.8 9.4 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.127 0.971 . . . . 0.0 112.951 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.435 ' C ' ' HB ' ' A' ' 9' ' ' THR . 29.5 t70 -68.09 -4.86 14.92 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.061 175.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm -131.02 146.56 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 119.378 0.99 . . . . 0.0 109.256 -169.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -148.97 139.17 13.21 Favored Pre-proline 0 C--O 1.241 0.633 0 C-N-CA 127.736 2.414 . . . . 0.0 107.348 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -45.75 -40.81 19.5 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.011 3.141 . . . . 0.0 116.263 -178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -62.96 -52.97 60.95 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.95 1.25 . . . . 0.0 110.674 -169.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.6 -38.32 78.89 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.133 0 CA-C-O 122.483 1.135 . . . . 0.0 109.591 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -62.32 -16.69 55.74 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 124.917 1.287 . . . . 0.0 111.374 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -93.85 -26.45 16.9 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.996 1.718 . . . . 0.0 112.334 169.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.65 -26.78 67.32 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 120.354 1.434 . . . . 0.0 109.701 168.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.62 154.45 94.55 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.699 2.8 . . . . 0.0 114.179 -170.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.8 157.61 55.33 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.418 2.745 . . . . 0.0 111.183 169.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.51 -46.84 65.6 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.08 0.952 . . . . 0.0 110.675 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.45 81.98 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.768 -0.583 . . . . 0.0 112.091 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.44 HG11 HD11 ' A' ' 44' ' ' ILE . 6.3 t -74.44 -34.2 35.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 O-C-N 121.449 -0.782 . . . . 0.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -60.24 -42.9 96.26 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.966 1.257 . . . . 0.0 109.434 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -46.07 65.71 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.135 173.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 -56.74 -54.85 41.53 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.59 -60.91 3.06 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 125.841 1.657 . . . . 0.0 109.91 -169.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.77 -39.58 92.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.986 1.266 . . . . 0.0 112.41 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.74 52.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 118.588 0.631 . . . . 0.0 109.684 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.433 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 9.5 mm-40 -66.48 -37.06 84.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 117.363 -1.303 . . . . 0.0 110.336 177.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.0 m0 -61.07 -47.44 86.33 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.636 1.562 . . . . 0.0 108.496 -175.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -75.72 -26.51 57.56 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -74.02 -48.1 32.43 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.163 0.892 . . . . 0.0 109.817 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 33.2 m -79.95 -36.91 35.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 124.62 1.168 . . . . 0.0 109.187 -170.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.126 -1.375 . . . . 0.0 110.619 -175.15 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 ptt? . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 119.219 -0.419 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -131.99 156.95 45.31 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 118.981 0.809 . . . . 0.0 110.048 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 pt -141.11 161.93 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -115.32 96.97 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.643 1.177 . . . . 0.0 107.907 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG2' HD21 ' A' ' 15' ' ' LEU . 85.9 t -87.58 102.19 12.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 11.5 tttp -71.35 125.74 27.78 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.43 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 32.9 p -88.78 157.2 18.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 123.689 1.709 . . . . 0.0 110.549 168.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.607 ' HB3' HG23 ' B' ' 683' ' ' ILE . 0.1 OUTLIER -61.35 -16.47 46.48 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 112.237 -2.256 . . . . 0.0 112.631 -172.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.6 t -76.96 -10.34 59.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.435 1.47 . . . . 0.0 110.273 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.93 36.8 6.58 Favored Glycine 0 C--N 1.337 0.626 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -169.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -116.09 157.01 25.38 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 173.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -127.77 113.61 16.2 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 120.029 1.286 . . . . 0.0 107.988 173.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.35 115.73 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 178.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.1 m -81.76 141.2 33.74 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 173.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD21 ' CG2' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -142.61 158.5 43.61 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-O 119.135 -0.459 . . . . 0.0 109.981 174.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -101.67 130.98 48.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.291 0.994 . . . . 0.0 108.605 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.7 m -144.31 -171.56 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 126.477 1.911 . . . . 0.0 109.154 -169.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.402 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 32.3 mt-10 -129.93 155.16 81.01 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 169.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -55.23 -30.81 73.41 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 CA-C-N 120.917 1.363 . . . . 0.0 112.387 170.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 p -87.4 3.15 48.22 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.593 1.557 . . . . 0.0 110.955 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 32.3 t0 -73.31 132.96 43.7 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.1 p -73.72 147.7 43.33 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 122.196 0.998 . . . . 0.0 110.705 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 5.9 mm -48.68 -42.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.317 169.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -58.48 -46.17 87.19 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 119.933 1.242 . . . . 0.0 110.839 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -74.73 -32.02 62.0 Favored 'General case' 0 C--N 1.331 -0.196 0 O-C-N 122.123 -0.36 . . . . 0.0 110.646 -176.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.3 t -59.25 -53.34 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 170.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -57.11 -36.64 70.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 119.864 1.211 . . . . 0.0 111.338 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.46 75.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.154 0.888 . . . . 0.0 110.524 178.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -68.55 -34.45 75.85 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.552 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 mm -63.2 -38.17 81.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 O-C-N 120.528 -1.357 . . . . 0.0 110.607 173.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -59.2 -37.77 78.25 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 120.264 1.393 . . . . 0.0 110.074 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.22 -37.69 88.23 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.005 0.366 . . . . 0.0 111.156 172.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.16 -26.71 18.11 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -169.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -122.84 -35.64 3.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 126.52 1.928 . . . . 0.0 112.807 -169.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.52 11.73 32.51 Favored Glycine 0 CA--C 1.528 0.849 0 C-N-CA 124.357 0.98 . . . . 0.0 112.844 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.9 mt -104.64 128.2 27.37 Favored Pre-proline 0 C--N 1.344 0.35 0 N-CA-C 107.985 -1.116 . . . . 0.0 107.985 -169.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -68.33 151.77 76.05 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.328 2.019 . . . . 0.0 111.56 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.72 -33.79 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.007 1.805 . . . . 0.0 114.353 -172.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.08 -23.26 62.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.882 0.849 . . . . 0.0 110.535 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -91.15 -5.46 54.98 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.215 1.006 . . . . 0.0 110.935 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.269 8.5 tt0 -119.27 139.75 51.39 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -168.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -118.39 158.57 25.02 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.846 1.203 . . . . 0.0 109.766 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -129.59 125.72 36.84 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -173.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.411 HG23 ' O ' ' A' ' 48' ' ' LYS . 3.7 mp -118.05 152.55 20.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 125.795 1.638 . . . . 0.0 107.933 176.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -137.26 126.32 24.41 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.24 42.99 10.89 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.5 24.71 41.89 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 114.13 -1.395 . . . . 0.0 112.899 173.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' O ' HG23 ' A' ' 44' ' ' ILE . 2.5 ptpt -144.29 153.62 42.21 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 118.773 1.286 . . . . 0.0 109.208 177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -90.47 147.83 23.14 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 120.156 1.344 . . . . 0.0 109.093 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.18 176.99 5.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -128.58 154.87 45.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 118.723 0.692 . . . . 0.0 109.752 169.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.22 -34.3 70.25 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.523 1.129 . . . . 0.0 112.844 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.32 7.45 52.85 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.427 1.013 . . . . 0.0 114.182 -175.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.4 mmt85 -114.61 -179.62 3.68 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 118.626 1.213 . . . . 0.0 108.852 -174.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.8 p -132.03 169.48 16.29 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 118.602 0.637 . . . . 0.0 110.077 -175.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 mt -58.78 -45.04 90.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 m -60.58 -31.43 70.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.909 1.284 . . . . 0.0 112.539 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.84 -24.35 67.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.772 1.169 . . . . 0.0 110.904 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -106.86 8.84 30.91 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.944 1.698 . . . . 0.0 112.46 176.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 m120 58.55 21.69 8.9 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.839 2.055 . . . . 0.0 112.781 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.8 mt -66.8 145.23 14.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 N-CA-C 106.092 -1.818 . . . . 0.0 106.092 169.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -127.88 -168.74 1.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.915 1.286 . . . . 0.0 108.175 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.52 160.06 7.5 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 124.897 1.279 . . . . 0.0 110.864 169.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 39.52 50.28 2.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 127.177 2.191 . . . . 0.0 109.723 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.7 m -120.97 149.43 42.66 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.104 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.6 m -103.31 142.14 34.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.445 0.641 . . . . 0.0 109.555 -169.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -124.77 174.12 8.12 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.496 2.319 . . . . 0.0 109.295 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -126.95 138.91 53.36 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.81 125.98 48.93 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 18.2 m -121.83 163.35 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 171.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.66 135.62 37.12 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 169.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -123.03 21.06 9.87 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.623 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.9 mm? 65.49 -33.43 0.17 Allowed 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 117.331 2.345 . . . . 0.0 117.331 169.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.7 167.48 7.31 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.637 1.108 . . . . 0.0 111.902 -169.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -172.09 40.41 0.17 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.172 0 N-CA-C 109.091 -1.603 . . . . 0.0 109.091 -174.015 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.096 0 CA-C-O 119.983 -0.343 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -73.84 0.31 13.63 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.315 1.057 . . . . 0.0 113.67 -176.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.66 158.3 44.04 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.094 1.758 . . . . 0.0 107.264 173.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -135.96 -78.62 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 116.548 -1.691 . . . . 0.0 108.0 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -72.99 167.03 28.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 122.254 1.841 . . . . 0.0 109.001 169.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.0 m -59.65 -17.18 31.8 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.146 0.978 . . . . 0.0 112.755 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -70.63 1.06 5.71 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.056 1.743 . . . . 0.0 114.469 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.607 HG23 ' HB3' ' A' ' 8' ' ' LEU . 1.1 mm -131.36 146.47 33.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 119.927 1.24 . . . . 0.0 109.337 -173.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -151.15 139.98 13.35 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.829 2.451 . . . . 0.0 107.788 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -49.13 -44.09 34.39 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.627 2.885 . . . . 0.0 115.743 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -64.89 -47.82 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.219 1.372 . . . . 0.0 111.68 -169.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 3.0 t -68.8 -31.55 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 122.2 1.0 . . . . 0.0 109.534 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -70.78 -25.14 62.76 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 121.244 -0.91 . . . . 0.0 110.669 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -79.56 -28.55 41.19 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.298 1.039 . . . . 0.0 110.948 169.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -64.31 -30.79 71.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.741 0.816 . . . . 0.0 112.054 173.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . 0.801 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.5 OUTLIER -60.62 150.83 73.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.683 1.593 . . . . 0.0 111.685 172.051 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . 0.801 ' HD2' HD13 ' B' ' 691' ' ' LEU . 53.3 Cg_endo -58.25 159.88 17.86 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 124.093 3.195 . . . . 0.0 111.115 168.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -56.84 -44.53 82.19 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.544 1.138 . . . . 0.0 110.456 173.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -56.53 -57.29 12.98 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 125.43 1.492 . . . . 0.0 113.069 -172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.504 ' HB ' HD12 ' B' ' 691' ' ' LEU . 42.5 t -70.99 -29.04 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -175.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -61.54 -43.35 99.01 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.833 1.197 . . . . 0.0 109.669 173.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -41.4 80.16 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 118.15 -0.929 . . . . 0.0 110.383 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -57.68 -52.23 66.3 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.3 -61.79 2.37 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.562 1.545 . . . . 0.0 109.282 -171.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.78 -37.43 81.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 119.273 0.942 . . . . 0.0 112.413 -175.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.58 -50.02 41.76 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.408 ' HB2' HD23 ' A' ' 73' ' ' LEU . 8.8 mm-40 -63.04 -39.91 96.15 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.606 175.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.623 ' CD1' HD21 ' A' ' 73' ' ' LEU . 37.3 m0 -61.0 -50.14 74.6 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 119.39 0.995 . . . . 0.0 108.843 -171.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -69.39 -31.79 70.4 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 118.171 0.441 . . . . 0.0 111.84 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -74.14 -33.26 63.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.258 0.481 . . . . 0.0 111.386 -174.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 24.0 m -103.2 -19.42 14.51 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 125.687 1.595 . . . . 0.0 109.935 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.304 0 C-N-CA 126.911 2.196 . . . . 0.0 111.782 172.228 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 119.495 -0.288 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -129.55 158.08 40.25 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.451 1.101 . . . . 0.0 109.871 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 pt -142.94 160.15 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -113.2 97.19 6.34 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.505 1.122 . . . . 0.0 107.978 -171.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.3 t -87.86 104.32 14.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' THR . 12.2 tttp -73.36 124.48 25.82 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 73.1 p -82.52 159.33 22.86 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 121.95 0.881 . . . . 0.0 110.237 168.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HB3' HG23 ' B' ' 683' ' ' ILE . 8.0 mt -60.06 -16.56 32.56 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 117.213 -1.375 . . . . 0.0 112.57 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.404 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 3.1 t -76.16 -10.03 59.09 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 121.432 1.924 . . . . 0.0 110.938 -178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.48 36.85 8.44 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 tmmm? -112.45 154.96 25.04 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 170.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 6' ' ' LYS . 1.3 m -126.24 112.96 16.36 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 119.949 1.25 . . . . 0.0 108.319 173.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -94.98 115.06 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 178.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 20.0 m -80.77 142.6 33.61 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 173.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.58 159.83 42.16 Favored 'General case' 0 CA--C 1.5 -0.98 0 CA-C-O 119.225 -0.416 . . . . 0.0 110.171 173.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -100.91 131.02 46.99 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.987 0.898 . . . . 0.0 109.02 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.1 m -145.2 -171.82 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 126.767 2.027 . . . . 0.0 108.814 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -132.98 156.03 80.51 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -54.43 -31.85 70.39 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.756 1.637 . . . . 0.0 112.736 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 p -87.53 2.66 50.09 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.923 1.689 . . . . 0.0 111.05 -179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -72.84 132.87 44.1 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.0 p -73.55 147.28 44.09 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 122.063 0.935 . . . . 0.0 110.423 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mm -49.28 -42.6 15.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.815 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -58.16 -46.21 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 120.235 1.379 . . . . 0.0 111.037 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.15 -31.65 62.8 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 122.198 -0.314 . . . . 0.0 110.565 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.1 t -61.68 -52.02 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 171.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -56.35 -37.3 69.84 Favored 'General case' 0 C--N 1.34 0.152 0 CA-C-N 119.896 1.226 . . . . 0.0 111.482 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.73 -32.96 74.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.167 0.894 . . . . 0.0 110.564 178.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -68.54 -35.02 76.87 Favored 'General case' 0 C--O 1.216 -0.664 0 O-C-N 121.129 -0.982 . . . . 0.0 109.459 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.3 mm -64.19 -36.77 78.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.08 0 O-C-N 120.315 -1.491 . . . . 0.0 110.08 174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -59.07 -38.03 78.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 120.535 1.516 . . . . 0.0 109.75 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.2 -38.38 90.93 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 122.066 -0.396 . . . . 0.0 111.243 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.71 19.02 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -169.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -123.13 -35.33 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.48 1.912 . . . . 0.0 112.749 -169.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.23 10.93 32.93 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 124.481 1.039 . . . . 0.0 112.745 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 67.2 mt -103.59 128.65 26.95 Favored Pre-proline 0 C--N 1.341 0.212 0 CA-C-N 118.533 1.166 . . . . 0.0 108.575 -169.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -68.79 152.23 74.06 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.686 2.257 . . . . 0.0 111.644 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -65.59 -32.86 47.5 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.867 1.711 . . . . 0.0 114.387 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -70.9 -24.2 62.43 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.355 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -89.93 -4.84 57.29 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.82 0.848 . . . . 0.0 111.06 -178.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.27 8.6 tt0 -121.43 137.6 54.64 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.139 1.376 . . . . 0.0 107.412 -168.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -113.19 158.59 20.25 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.723 1.147 . . . . 0.0 110.366 170.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tp -125.32 126.13 44.59 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.469 HD11 HG11 ' B' ' 695' ' ' VAL . 70.0 mt -120.61 154.73 23.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.52 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.77 121.65 14.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 174.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.97 37.73 5.36 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 169.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.54 15.25 57.23 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-O 118.622 -1.099 . . . . 0.0 113.827 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -134.89 131.91 37.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 119.544 1.672 . . . . 0.0 110.128 173.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.44 146.79 52.86 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.844 0.858 . . . . 0.0 108.919 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 45' ' ' PHE . 8.7 mt -98.06 -178.21 3.99 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 172.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -137.51 155.85 48.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.17 0.895 . . . . 0.0 109.136 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.61 -35.64 68.52 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.77 1.628 . . . . 0.0 112.874 -168.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.34 6.51 57.03 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 124.305 0.955 . . . . 0.0 114.212 -175.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 -114.29 -179.74 3.72 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 118.651 1.225 . . . . 0.0 109.145 -173.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 63.3 p -131.38 170.34 14.78 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.441 0.639 . . . . 0.0 110.364 -176.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.49 -44.75 93.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.332 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.8 m -60.43 -31.02 70.02 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.664 1.186 . . . . 0.0 112.781 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -65.28 -24.21 67.24 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.797 1.181 . . . . 0.0 110.945 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.499 ' CG ' HD22 ' A' ' 50' ' ' LEU . 83.5 m-85 -106.63 10.4 31.07 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.81 1.644 . . . . 0.0 112.604 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.15 19.39 7.36 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.73 2.412 . . . . 0.0 113.886 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 mt -64.43 143.57 15.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 169.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -126.03 -168.35 1.84 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.884 1.274 . . . . 0.0 107.642 178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.9 ptpt -58.07 163.83 2.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.33 1.052 . . . . 0.0 111.151 170.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.268 7.3 pt-20 40.77 46.03 2.21 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.55 1.94 . . . . 0.0 110.293 175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.0 m -121.73 151.19 40.79 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.371 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.1 m -102.98 145.94 29.1 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.581 0.705 . . . . 0.0 109.582 -169.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -129.07 176.23 8.06 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.381 2.272 . . . . 0.0 109.023 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -128.39 140.87 51.62 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 3.2 tm? -120.41 134.29 55.29 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.415 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.93 165.55 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.21 130.21 53.41 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 176.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.35 20.79 11.87 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.506 0.722 . . . . 0.0 112.778 -175.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.582 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.8 mm? 63.75 -33.91 0.14 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 169.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -67.52 169.52 9.06 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.754 1.615 . . . . 0.0 111.213 -169.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.32 42.35 0.27 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.243 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -174.913 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.814 -0.514 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -133.13 20.37 4.07 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.038 0.935 . . . . 0.0 111.702 -170.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -123.32 141.32 52.11 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 -177.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 86.6 t80 47.25 54.25 15.13 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 123.799 0.839 . . . . 0.0 110.669 -168.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -74.61 -169.77 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.301 2.668 . . . . 0.0 110.245 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.3 m -60.88 15.83 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.26 2.224 . . . . 0.0 114.136 169.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.404 ' C ' ' HB ' ' A' ' 9' ' ' THR . 34.8 t70 -94.36 -0.98 54.53 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.756 1.622 . . . . 0.0 111.841 169.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.5 HG21 ' CH2' ' B' ' 703' ' ' TRP . 1.2 mm -135.71 143.18 37.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -174.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -151.36 138.42 11.99 Favored Pre-proline 0 C--O 1.237 0.447 0 C-N-CA 126.824 2.05 . . . . 0.0 107.743 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.41 -37.39 19.36 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 124.204 3.269 . . . . 0.0 115.688 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -63.67 -53.96 43.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 120.396 1.453 . . . . 0.0 110.228 -170.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -69.26 -41.53 81.14 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-O 122.122 0.963 . . . . 0.0 109.479 -179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -60.25 -18.46 49.03 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 125.582 1.553 . . . . 0.0 111.688 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -93.89 -30.69 14.65 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.212 1.405 . . . . 0.0 111.821 173.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -59.31 -27.72 66.14 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 122.672 1.225 . . . . 0.0 110.566 169.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 153.89 74.12 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.768 2.827 . . . . 0.0 113.604 -178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -63.36 159.02 41.82 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.795 2.996 . . . . 0.0 111.359 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.29 -48.05 58.42 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.021 0.528 . . . . 0.0 110.639 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.48 98.93 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.788 -0.57 . . . . 0.0 111.854 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.469 HG11 HD11 ' A' ' 44' ' ' ILE . 2.9 t -70.17 -33.09 53.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.89 -43.79 98.0 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 119.484 1.038 . . . . 0.0 109.698 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -42.94 75.85 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.198 0.908 . . . . 0.0 110.573 176.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.14 -51.14 71.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -60.83 3.24 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.161 -1.382 . . . . 0.0 109.961 -173.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.36 -38.69 87.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 119.276 0.943 . . . . 0.0 112.032 -174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.89 -52.36 25.38 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.429 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 15.2 mm-40 -61.29 -39.46 90.53 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 117.8 -1.095 . . . . 0.0 110.114 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.582 ' CD1' HD21 ' A' ' 73' ' ' LEU . 42.6 m0 -60.4 -46.84 88.57 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.449 1.477 . . . . 0.0 108.631 -174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 54.4 pttt -79.18 -25.89 42.72 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 19.0 mmt85 -72.24 -45.33 60.68 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.271 0.941 . . . . 0.0 109.164 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.7 m -80.48 -31.27 37.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.326 -170.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.214 0 C-N-CA 126.069 1.795 . . . . 0.0 111.931 172.83 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ptt? . . . . . 0 N--CA 1.5 2.056 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -129.45 157.64 41.42 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 124.305 1.042 . . . . 0.0 109.844 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.84 159.96 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -113.62 97.75 6.62 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.66 1.184 . . . . 0.0 108.298 -171.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.17 102.66 12.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.2 tttp -68.19 127.17 31.94 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 67.5 p -82.37 164.52 20.99 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.347 169.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 70' ' ' VAL . 12.1 mt -61.42 -18.14 57.47 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 116.239 -1.839 . . . . 0.0 111.992 175.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.42 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 13.0 t -76.56 -12.57 60.04 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 122.295 2.316 . . . . 0.0 109.764 -179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.74 34.96 8.68 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-O 118.605 -1.108 . . . . 0.0 111.154 -170.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.72 124.45 48.52 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 173.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.79 112.29 24.05 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.72 111.99 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 176.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.2 m -76.15 141.99 41.74 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 171.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.94 160.55 40.13 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 118.933 -0.556 . . . . 0.0 109.723 171.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -102.37 131.38 49.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 122.011 0.91 . . . . 0.0 108.956 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.7 m -146.21 -170.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 C-N-CA 127.306 2.243 . . . . 0.0 108.448 -169.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -134.81 158.74 74.34 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 169.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -53.27 -37.48 80.79 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.478 1.452 . . . . 0.0 111.544 172.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.0 m -92.44 9.31 34.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 120.992 -1.068 . . . . 0.0 110.044 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -69.3 134.99 49.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -76.96 148.33 36.38 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.012 0.91 . . . . 0.0 110.417 -177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.4 mm -49.77 -41.65 17.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.239 169.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -53.93 -48.52 70.14 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 119.598 1.09 . . . . 0.0 110.422 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -75.23 -32.68 61.2 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.494 HG21 HD21 ' A' ' 56' ' ' LEU . 40.3 t -62.08 -52.77 56.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -56.75 -36.76 70.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 120.002 1.274 . . . . 0.0 111.04 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.29 77.56 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 119.305 0.957 . . . . 0.0 111.031 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -66.33 -34.43 77.95 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 120.807 -1.183 . . . . 0.0 109.69 171.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.5 mm -64.65 -38.3 82.31 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 O-C-N 120.633 -1.292 . . . . 0.0 109.825 174.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -37.29 73.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.257 1.39 . . . . 0.0 109.942 172.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -68.68 -31.22 70.17 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.904 -0.57 . . . . 0.0 111.664 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -98.86 -23.86 15.2 Favored 'General case' 0 C--N 1.35 0.607 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -123.05 -34.65 3.13 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.235 1.814 . . . . 0.0 112.561 -170.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 5.92 45.02 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.274 0.94 . . . . 0.0 112.494 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 89.6 mt -94.3 124.47 55.57 Favored Pre-proline 0 C--N 1.341 0.214 0 CA-C-O 117.41 -1.281 . . . . 0.0 108.107 -169.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -64.06 143.62 85.08 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.786 2.324 . . . . 0.0 111.054 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.75 -32.0 78.37 Favored 'Trans proline' 0 CA--C 1.514 -0.476 0 C-N-CA 122.208 1.938 . . . . 0.0 113.429 -175.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -66.56 -16.57 64.25 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.222 0.534 . . . . 0.0 111.995 -177.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -111.82 2.83 17.28 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.689 1.596 . . . . 0.0 110.478 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -114.75 142.91 45.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 120.069 -1.645 . . . . 0.0 108.787 -168.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.79 157.02 27.32 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.513 1.051 . . . . 0.0 108.888 169.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.6 tp -129.18 127.84 42.15 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.597 HD11 HG11 ' B' ' 695' ' ' VAL . 87.9 mt -121.26 149.84 24.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 50' ' ' LEU . 33.2 t80 -138.84 122.96 17.99 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 173.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.92 38.31 4.41 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.57 14.94 57.7 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 124.743 1.163 . . . . 0.0 113.788 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' ILE . 15.5 ptpt -130.47 167.99 17.74 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 118.586 1.193 . . . . 0.0 108.803 169.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -113.37 145.46 41.07 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.253 1.421 . . . . 0.0 107.626 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.409 HD12 ' CD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -105.54 166.7 10.26 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.78 155.19 46.35 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 118.701 0.682 . . . . 0.0 111.267 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.66 -38.92 61.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.907 2.083 . . . . 0.0 112.668 -168.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.39 11.39 38.32 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.459 1.028 . . . . 0.0 113.935 -174.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -121.8 -179.6 4.18 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 118.798 1.299 . . . . 0.0 109.334 -175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -131.75 168.31 18.01 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 118.583 0.629 . . . . 0.0 110.055 -174.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 HG21 ' A' ' 26' ' ' VAL . 41.5 mt -60.47 -41.91 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.045 0.45 . . . . 0.0 109.925 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.5 p -61.6 -32.02 72.12 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.129 1.372 . . . . 0.0 112.355 175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -64.85 -18.58 65.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 118.921 0.782 . . . . 0.0 111.112 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.409 ' CD1' HD12 ' A' ' 50' ' ' LEU . 83.4 m-85 -115.41 16.44 16.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.982 1.713 . . . . 0.0 111.487 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 69.36 2.05 3.54 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.569 2.348 . . . . 0.0 114.409 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 25.3 mt -61.85 142.85 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 125.51 1.524 . . . . 0.0 107.815 178.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -125.73 -166.85 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.384 1.474 . . . . 0.0 107.493 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -59.9 165.88 2.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.33 -0.856 . . . . 0.0 110.455 171.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 41.95 43.95 2.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.833 2.053 . . . . 0.0 110.54 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 65.3 m -120.36 150.84 40.11 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.109 -172.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 22.6 m -103.7 144.51 31.37 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -169.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.58 174.69 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.517 2.327 . . . . 0.0 108.776 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -127.42 128.04 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.6 tm? -100.94 135.26 42.68 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.507 HG12 HD21 ' A' ' 8' ' ' LEU . 2.3 m -132.03 162.84 38.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 169.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' H ' ' A' ' 73' ' ' LEU . 1.5 tm? -101.99 129.29 48.25 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 176.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? -121.89 25.27 9.24 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.468 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.2 mm? 66.47 -52.69 0.43 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 169.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt85 -157.39 168.45 27.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 120.887 1.676 . . . . 0.0 112.165 -168.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.37 -37.0 54.53 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 123.71 0.671 . . . . 0.0 112.747 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.0 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 -177.885 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -60.85 152.89 26.04 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.79 0.836 . . . . 0.0 111.254 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.12 156.55 17.9 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.702 0.801 . . . . 0.0 111.588 170.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 3.7 t80 42.12 63.42 6.8 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 125.345 1.458 . . . . 0.0 111.202 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -71.58 -171.36 0.63 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.191 1.927 . . . . 0.0 108.988 169.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.3 m -60.43 17.01 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.452 1.901 . . . . 0.0 114.108 169.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.42 ' C ' ' HB ' ' A' ' 9' ' ' THR . 31.3 t70 -95.3 -7.7 38.0 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 127.152 2.181 . . . . 0.0 112.356 171.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.424 HG23 ' CB ' ' A' ' 8' ' ' LEU . 1.2 mm -133.46 147.45 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -173.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -153.45 137.94 11.03 Favored Pre-proline 0 C--O 1.241 0.619 0 C-N-CA 127.605 2.362 . . . . 0.0 106.902 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -48.53 -41.68 36.47 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.379 2.72 . . . . 0.0 115.172 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -62.75 -49.53 74.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 120.109 1.322 . . . . 0.0 110.688 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -68.35 -37.93 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 O-C-N 120.993 -1.067 . . . . 0.0 109.85 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -63.89 -15.76 59.8 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.977 1.311 . . . . 0.0 110.545 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -95.41 -26.5 15.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.832 1.653 . . . . 0.0 112.028 171.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -59.74 -30.11 68.62 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.335 1.425 . . . . 0.0 109.053 168.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.66 152.65 85.72 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 129.005 2.922 . . . . 0.0 113.504 -170.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -64.65 151.19 86.58 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 123.451 2.768 . . . . 0.0 110.952 171.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -70.6 -37.71 73.92 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.692 -0.63 . . . . 0.0 110.81 -176.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.18 -39.84 75.0 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 121.678 -0.639 . . . . 0.0 111.754 -174.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.597 HG11 HD11 ' A' ' 44' ' ' ILE . 6.5 t -74.9 -31.36 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 121.248 -0.907 . . . . 0.0 109.583 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -58.64 -42.13 87.62 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.517 1.053 . . . . 0.0 109.155 169.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 -47.04 66.78 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.614 0.766 . . . . 0.0 110.705 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -54.57 -55.27 31.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 176.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.83 -62.08 2.14 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 125.432 1.493 . . . . 0.0 110.123 -170.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.3 pp -59.68 -38.02 80.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 119.624 1.102 . . . . 0.0 112.162 -175.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.93 -50.07 38.8 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 118.512 0.596 . . . . 0.0 110.027 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -63.09 -37.08 85.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 119.05 -0.5 . . . . 0.0 111.05 176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.468 ' CD1' HD21 ' A' ' 73' ' ' LEU . 34.6 m0 -62.07 -49.82 74.43 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 -174.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -72.28 -24.09 61.29 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.171 0.896 . . . . 0.0 112.59 177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -66.55 -49.84 65.14 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.386 0.994 . . . . 0.0 110.626 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 29.7 p -71.24 -39.56 71.58 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.609 1.095 . . . . 0.0 109.305 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.332 0 C-N-CA 126.875 2.179 . . . . 0.0 111.51 175.677 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 ptt? . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 119.3 -0.381 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -129.74 157.14 42.99 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 119.185 0.902 . . . . 0.0 109.946 172.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 pt -140.7 162.22 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 175.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -116.9 97.55 6.02 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.308 1.043 . . . . 0.0 108.539 -169.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.9 t -87.08 102.98 12.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.419 ' HD3' HG13 ' B' ' 687' ' ' VAL . 29.9 tttt -67.58 124.46 23.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 170.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 66.7 p -81.38 163.18 23.02 Favored 'General case' 0 N--CA 1.432 -1.332 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.492 169.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.407 ' HB3' HG23 ' B' ' 683' ' ' ILE . 7.5 mt -61.66 -17.69 56.45 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.552 178.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -75.72 -15.26 60.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 122.148 2.249 . . . . 0.0 109.853 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.55 35.1 6.65 Favored Glycine 0 C--N 1.339 0.697 0 CA-C-O 118.505 -1.164 . . . . 0.0 111.001 -170.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.78 121.97 42.2 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.27 114.02 26.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.93 115.08 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.8 m -80.38 142.19 34.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.63 158.3 43.83 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.392 173.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -100.65 130.48 46.71 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 122.211 1.005 . . . . 0.0 108.797 -178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.5 m -145.63 -171.55 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 126.878 2.071 . . . . 0.0 108.504 -169.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -133.15 157.7 77.61 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -54.02 -35.87 82.48 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.56 1.507 . . . . 0.0 111.922 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.2 m -93.3 10.75 30.71 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.121 -0.987 . . . . 0.0 110.133 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -70.76 135.88 48.5 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 169.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.5 p -76.31 148.92 37.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.074 0.94 . . . . 0.0 110.64 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.52 -42.57 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.252 169.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -57.77 -45.41 85.98 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 120.024 1.284 . . . . 0.0 110.768 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -74.95 -33.15 61.9 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.029 -0.419 . . . . 0.0 110.753 -176.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.51 -52.41 61.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.265 1.026 . . . . 0.0 108.713 171.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -56.49 -36.2 68.86 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.975 1.261 . . . . 0.0 111.271 175.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.93 76.81 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 119.239 0.927 . . . . 0.0 110.633 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -67.5 -34.17 76.57 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 121.024 -1.048 . . . . 0.0 110.062 170.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.9 mm -64.1 -37.35 79.63 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.008 0 O-C-N 120.264 -1.523 . . . . 0.0 110.008 173.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.87 -38.29 78.45 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 120.429 1.468 . . . . 0.0 109.922 173.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.52 -37.79 88.67 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 117.901 0.319 . . . . 0.0 110.87 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.08 -27.62 17.65 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.52 0.6 . . . . 0.0 112.362 -169.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -122.31 -36.24 2.99 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 126.352 1.861 . . . . 0.0 113.179 -168.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.4 9.23 31.75 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.284 0.945 . . . . 0.0 112.87 174.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.21 126.23 37.0 Favored Pre-proline 0 C--N 1.341 0.225 0 CA-C-N 118.741 1.271 . . . . 0.0 108.358 -169.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -66.76 144.57 72.0 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.584 2.189 . . . . 0.0 111.286 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.05 -33.97 81.42 Favored 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.362 2.041 . . . . 0.0 114.042 -171.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -70.88 -23.32 62.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.162 0.506 . . . . 0.0 110.902 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -94.5 -4.37 48.23 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.232 1.413 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.252 9.9 tt0 -112.37 144.08 42.41 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.587 1.555 . . . . 0.0 107.51 -169.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -119.93 160.39 22.8 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.759 1.163 . . . . 0.0 109.781 170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tp -128.61 128.34 44.02 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.9 mp -116.27 159.86 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 124.829 1.252 . . . . 0.0 108.383 172.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.546 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.8 t80 -144.83 126.15 14.82 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 172.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.2 38.22 4.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 169.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 87.82 20.41 50.6 Favored Glycine 0 CA--C 1.528 0.876 0 CA-C-O 118.698 -1.056 . . . . 0.0 112.98 175.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -144.66 135.6 24.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.499 1.649 . . . . 0.0 110.489 175.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -69.76 151.3 45.95 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.946 0.898 . . . . 0.0 109.484 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 45' ' ' PHE . 7.3 mt -105.46 176.19 5.25 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 169.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -135.7 157.35 47.08 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 120.961 -1.087 . . . . 0.0 109.668 172.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -55.37 -36.66 66.6 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.518 1.527 . . . . 0.0 113.098 -168.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.51 6.68 57.1 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.241 0.924 . . . . 0.0 114.329 -173.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -118.58 178.05 4.6 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 118.448 1.124 . . . . 0.0 109.105 -171.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 37.4 p -130.97 167.63 18.71 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 118.404 0.547 . . . . 0.0 109.609 -174.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.7 mt -61.01 -40.43 93.52 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.716 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 p -61.63 -32.2 72.34 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.819 1.648 . . . . 0.0 113.264 174.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -61.38 -28.0 68.93 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.992 0.815 . . . . 0.0 109.672 176.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.508 ' CG ' HD22 ' A' ' 50' ' ' LEU . 80.4 m-85 -106.29 9.5 31.98 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.338 1.455 . . . . 0.0 111.809 -178.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 60.63 18.42 8.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 127.334 2.254 . . . . 0.0 113.61 175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 mt -63.98 146.08 13.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -127.81 -169.15 2.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.038 1.335 . . . . 0.0 107.614 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 162.52 4.45 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.157 172.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 40.14 49.91 2.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.894 2.078 . . . . 0.0 109.822 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -123.58 152.08 42.26 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 113.08 -1.873 . . . . 0.0 107.832 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 m -103.14 146.8 27.85 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.504 0.722 . . . . 0.0 109.881 -169.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -132.08 174.96 9.66 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 128.275 2.63 . . . . 0.0 109.282 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -127.77 131.75 49.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.473 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.1 tm? -103.56 133.61 48.31 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 174.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 m -130.29 167.13 26.17 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 O-C-N 123.903 0.752 . . . . 0.0 108.986 169.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -105.86 125.09 50.58 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 175.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.494 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.7 OUTLIER -113.16 17.66 18.53 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 123.994 0.918 . . . . 0.0 112.649 175.466 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.494 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.1 mp 64.48 -44.98 0.31 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 116.319 1.97 . . . . 0.0 116.319 172.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -157.76 178.64 10.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.92 1.691 . . . . 0.0 111.254 -169.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.12 44.28 2.6 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.697 1.141 . . . . 0.0 113.105 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.238 0 N-CA-C 108.043 -2.023 . . . . 0.0 108.043 -176.106 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.947 0 CA-C-O 121.657 0.587 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -65.13 155.4 34.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.699 0.8 . . . . 0.0 110.825 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 26.1 mmt -68.1 158.15 33.7 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 84.4 t80 48.68 57.48 18.2 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 123.377 0.671 . . . . 0.0 111.02 -169.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -73.18 -172.38 1.0 Allowed 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.494 2.796 . . . . 0.0 110.698 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.6 m -55.88 -13.69 1.98 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.714 1.606 . . . . 0.0 113.939 172.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.81 -3.96 0.39 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.048 1.739 . . . . 0.0 114.527 170.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.516 HG21 ' CH2' ' B' ' 703' ' ' TRP . 4.9 mm -135.4 136.78 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 -172.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -141.17 134.58 14.61 Favored Pre-proline 0 C--O 1.239 0.51 0 C-N-CA 126.958 2.103 . . . . 0.0 108.384 -174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -45.35 -43.42 17.12 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.961 3.107 . . . . 0.0 116.057 -175.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -61.02 -54.54 43.69 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.209 1.368 . . . . 0.0 109.437 -171.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . 0.419 HG13 ' HD3' ' A' ' 6' ' ' LYS . 6.3 t -65.84 -36.76 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 109.878 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -65.7 -34.9 79.27 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.594 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.52 -23.81 53.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.036 0.934 . . . . 0.0 112.506 170.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -63.11 -38.9 93.03 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.486 1.039 . . . . 0.0 112.276 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 164.79 58.38 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 124.381 1.072 . . . . 0.0 110.479 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -69.14 149.43 70.85 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.952 -172.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -61.04 -28.89 69.39 Favored 'General case' 0 C--O 1.223 -0.324 0 O-C-N 121.352 -0.843 . . . . 0.0 112.998 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.93 -46.31 65.62 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.624 0.726 . . . . 0.0 111.162 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.41 -33.89 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.0 -40.59 85.37 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 119.153 0.888 . . . . 0.0 110.04 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -42.66 77.23 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.32 1.048 . . . . 0.0 110.193 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.39 -55.48 32.99 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -63.76 1.16 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.302 -170.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.9 pp -59.77 -39.13 83.84 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.837 -174.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.32 -49.38 67.2 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.959 0.799 . . . . 0.0 109.132 -175.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.401 ' CB ' HD13 ' A' ' 73' ' ' LEU . 20.1 mm-40 -65.68 -42.44 91.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 123.268 0.627 . . . . 0.0 111.599 176.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.516 ' CH2' HG21 ' B' ' 683' ' ' ILE . 53.8 m0 -59.49 -45.11 92.63 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -177.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? -65.73 -45.75 81.5 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 125.326 1.451 . . . . 0.0 111.39 175.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -61.93 -49.17 77.22 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.027 0.531 . . . . 0.0 111.045 -175.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 39.8 p -77.4 -29.14 52.97 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.852 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 126.796 2.141 . . . . 0.0 112.53 179.544 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 ptt? . . . . . 0 N--CA 1.501 2.076 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -130.14 157.63 41.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.506 1.048 . . . . 0.0 110.104 171.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.9 pt -140.87 162.98 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -117.63 97.66 5.98 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 124.508 1.123 . . . . 0.0 108.652 -169.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.1 t -88.72 104.2 14.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 120.327 -1.483 . . . . 0.0 107.186 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HD3' HG13 ' B' ' 687' ' ' VAL . 26.3 tttt -70.69 124.14 23.58 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.444 ' OG1' HG22 ' A' ' 9' ' ' THR . 65.8 p -82.12 162.2 22.57 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.456 169.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 70' ' ' VAL . 11.3 mt -60.28 -15.96 29.87 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 116.619 -1.658 . . . . 0.0 111.72 179.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.444 HG22 ' OG1' ' A' ' 7' ' ' THR . 5.5 t -77.64 -13.42 59.91 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 121.875 2.125 . . . . 0.0 110.133 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.51 36.39 6.54 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-O 118.52 -1.156 . . . . 0.0 110.419 -169.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -123.49 120.85 34.14 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 118.892 1.346 . . . . 0.0 107.688 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.93 114.73 27.35 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.1 115.73 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 174.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.9 m -81.27 142.92 32.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.26 158.15 43.89 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.207 174.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -99.67 130.9 45.93 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.918 0.866 . . . . 0.0 108.884 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 m -145.59 -170.77 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 126.714 2.006 . . . . 0.0 108.762 -169.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -134.44 157.04 78.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 169.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -55.06 -31.87 76.84 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 121.58 1.52 . . . . 0.0 112.251 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -94.57 9.17 39.68 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 120.759 -1.213 . . . . 0.0 109.995 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -72.68 134.93 45.3 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 172.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.5 p -76.73 149.74 36.32 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.173 0.987 . . . . 0.0 110.58 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.7 mm -49.4 -42.18 15.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.21 169.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.64 -45.8 84.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.259 1.391 . . . . 0.0 110.873 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -76.33 -32.65 58.81 Favored 'General case' 0 C--O 1.228 -0.068 0 O-C-N 122.187 -0.321 . . . . 0.0 110.978 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.5 t -59.02 -52.46 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 124.082 0.953 . . . . 0.0 108.745 170.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -56.68 -36.53 69.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 120.048 1.295 . . . . 0.0 111.386 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.94 -34.14 77.44 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.409 1.004 . . . . 0.0 110.621 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.3 mttm -67.46 -35.04 78.41 Favored 'General case' 0 C--O 1.219 -0.54 0 O-C-N 120.871 -1.143 . . . . 0.0 109.741 170.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mm -64.05 -37.27 79.4 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 120.019 -1.676 . . . . 0.0 109.984 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -58.93 -37.76 77.41 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 120.553 1.524 . . . . 0.0 109.825 173.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.43 -36.6 84.27 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.034 0.379 . . . . 0.0 110.933 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.58 -27.77 16.42 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -169.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.2 -34.97 3.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.379 1.871 . . . . 0.0 112.98 -169.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.66 11.02 33.98 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 124.479 1.037 . . . . 0.0 113.009 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 76.6 mt -104.28 126.01 32.71 Favored Pre-proline 0 C--N 1.343 0.287 0 CA-C-N 118.559 1.18 . . . . 0.0 108.203 -169.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -67.0 152.22 80.67 Favored 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 122.878 2.385 . . . . 0.0 111.556 179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.67 -32.5 47.41 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.617 1.545 . . . . 0.0 114.618 -171.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.04 -24.07 61.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.616 0.722 . . . . 0.0 110.314 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -86.14 -6.27 59.04 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 124.239 1.016 . . . . 0.0 111.033 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.275 9.9 tt0 -119.65 144.16 47.32 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 120.602 -1.311 . . . . 0.0 109.02 -167.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -121.09 160.24 24.07 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.759 0.709 . . . . 0.0 109.426 169.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.63 129.59 46.09 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 -176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.528 HD11 HG11 ' B' ' 695' ' ' VAL . 3.6 mp -114.79 153.9 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 108.328 171.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.636 ' HB3' HD21 ' A' ' 50' ' ' LEU . 27.4 t80 -140.7 125.89 18.56 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.4 40.49 8.0 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.954 1.302 . . . . 0.0 114.389 169.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.13 18.68 49.3 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.191 -1.368 . . . . 0.0 113.095 173.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -145.18 142.42 29.57 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 119.584 1.692 . . . . 0.0 110.794 178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -77.32 151.08 35.13 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.86 1.264 . . . . 0.0 109.69 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.636 HD21 ' HB3' ' A' ' 45' ' ' PHE . 5.9 mt -112.66 158.63 19.78 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.0 0.92 . . . . 0.0 108.683 176.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -115.76 153.17 31.89 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -57.46 -36.03 70.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.317 1.447 . . . . 0.0 112.161 -169.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.9 1.55 83.74 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.887 -0.952 . . . . 0.0 114.287 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.8 mtt85 -105.66 176.3 5.21 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 119.001 1.401 . . . . 0.0 109.382 -177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 57.5 p -129.93 167.07 18.78 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -175.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.0 mt -57.52 -44.67 85.27 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.389 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 t -63.74 -30.25 71.37 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.528 1.531 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.78 -31.1 72.01 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.623 1.101 . . . . 0.0 109.941 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -96.52 6.3 49.03 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.241 1.416 . . . . 0.0 112.125 175.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.99 19.23 10.59 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 127.352 2.261 . . . . 0.0 113.542 177.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.4 mt -63.64 147.55 12.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 169.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -128.48 -168.97 1.99 Allowed 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -60.08 162.48 5.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 120.987 -1.071 . . . . 0.0 111.141 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 40.27 50.07 2.58 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.009 2.124 . . . . 0.0 109.519 176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.4 m -122.82 151.93 41.2 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 112.967 -1.924 . . . . 0.0 108.004 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.2 m -102.94 145.52 29.71 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.611 0.765 . . . . 0.0 109.883 -169.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.4 tp -131.54 173.89 10.65 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 128.13 2.572 . . . . 0.0 108.847 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 8.6 m80 -127.43 134.7 49.85 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.644 -0.693 . . . . 0.0 109.41 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 2.1 tm? -106.66 134.41 49.85 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.464 HG12 HD21 ' A' ' 8' ' ' LEU . 3.7 m -131.8 167.72 25.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 O-C-N 123.928 0.768 . . . . 0.0 109.643 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -104.78 130.59 52.85 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.482 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -119.23 18.29 13.03 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 124.682 1.193 . . . . 0.0 112.884 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.3 mp 62.38 -29.75 0.08 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 119.329 3.085 . . . . 0.0 119.329 169.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 83.3 mmt-85 -66.65 173.55 3.38 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 120.807 1.64 . . . . 0.0 112.259 -169.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -169.3 38.67 0.2 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -175.124 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -133.39 18.0 4.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.848 0.859 . . . . 0.0 112.262 -170.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.47 129.98 11.44 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.933 0.893 . . . . 0.0 109.291 -173.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 77.1 t80 40.77 57.71 8.22 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.627 1.571 . . . . 0.0 113.364 -178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.21 -170.28 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.369 2.046 . . . . 0.0 110.196 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 3.8 p -55.32 -17.61 5.01 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.061 1.344 . . . . 0.0 113.44 171.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -59.97 -1.31 0.28 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.285 1.834 . . . . 0.0 115.702 175.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.635 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.9 mm -133.92 138.36 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -172.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -142.27 135.19 13.94 Favored Pre-proline 0 C--O 1.238 0.46 0 C-N-CA 127.64 2.376 . . . . 0.0 107.166 -177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -47.82 -38.03 29.54 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.697 2.931 . . . . 0.0 115.394 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.16 -53.68 45.66 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.606 1.094 . . . . 0.0 109.924 -170.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . 0.425 HG13 ' HD3' ' A' ' 6' ' ' LYS . 20.8 t -66.3 -36.33 77.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-O 122.143 0.973 . . . . 0.0 109.859 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -67.04 -26.85 66.97 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.705 -0.664 . . . . 0.0 110.193 -174.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -82.3 -25.93 33.52 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.245 1.018 . . . . 0.0 112.032 169.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.35 -31.47 69.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.724 1.21 . . . . 0.0 110.907 169.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . 0.736 HD13 ' HD2' ' B' ' 692' ' ' PRO . 0.2 OUTLIER -66.19 149.61 97.65 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 127.504 2.321 . . . . 0.0 111.034 177.087 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . 0.736 ' HD2' HD13 ' B' ' 691' ' ' LEU . 54.5 Cg_endo -58.98 142.18 99.08 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.33 3.354 . . . . 0.0 111.676 169.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -54.47 -36.39 64.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.025 0.93 . . . . 0.0 112.146 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -53.92 -59.28 4.83 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 126.146 1.778 . . . . 0.0 112.336 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.528 HG11 HD11 ' A' ' 44' ' ' ILE . 40.5 t -72.25 -31.43 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -176.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.59 -44.02 93.5 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 119.069 0.85 . . . . 0.0 110.173 173.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -43.3 73.11 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.807 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.91 -56.09 23.45 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 122.077 0.941 . . . . 0.0 108.79 175.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.26 -63.29 1.35 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.735 -1.575 . . . . 0.0 109.623 -170.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.4 pp -58.81 -39.07 80.06 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 118.916 0.78 . . . . 0.0 111.898 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.33 -51.12 60.48 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.83 -39.3 93.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 119.175 -0.441 . . . . 0.0 110.925 177.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' B' ' 683' ' ' ILE . 52.9 m0 -62.24 -43.68 98.28 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 47.0 pttt -80.32 -28.66 38.15 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.534 -0.745 . . . . 0.0 112.089 178.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -62.47 -49.7 74.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.234 0.924 . . . . 0.0 109.498 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 25.2 p -72.48 -35.68 68.27 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.182 0.301 . . . . 0.0 110.333 178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.189 0 C-N-CA 128.578 2.99 . . . . 0.0 113.929 174.164 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.3 ptt? . . . . . 0 N--CA 1.498 1.956 0 CA-C-O 119.225 -0.416 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -125.25 155.14 40.57 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.179 0.992 . . . . 0.0 109.383 174.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.4 pt -141.45 157.81 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -111.88 97.98 7.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.328 1.051 . . . . 0.0 108.539 -171.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 103.33 13.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 tttt -68.19 125.42 26.32 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.44 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 81.6 p -81.82 164.28 21.75 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.738 169.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 10.7 mt -61.52 -18.14 57.83 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 116.542 -1.694 . . . . 0.0 111.947 177.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.418 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 12.7 t -77.54 -12.07 59.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 121.805 2.093 . . . . 0.0 109.832 -178.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.89 34.26 8.45 Favored Glycine 0 N--CA 1.443 -0.858 0 CA-C-O 118.48 -1.178 . . . . 0.0 111.497 -169.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -117.86 120.69 38.65 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.59 117.88 25.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 174.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -100.21 116.11 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.557 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.1 m -82.61 143.24 31.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -144.83 158.12 43.91 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.148 174.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -100.98 131.96 46.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.952 0.882 . . . . 0.0 108.958 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -145.91 -171.6 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 126.804 2.042 . . . . 0.0 109.114 -170.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 21' ' ' ASP . 7.8 mp0 -126.35 156.53 72.48 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 169.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -54.93 -37.37 93.27 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 120.907 1.36 . . . . 0.0 110.508 169.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -85.5 4.76 34.33 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.782 1.633 . . . . 0.0 110.872 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.454 ' HB2' ' H ' ' A' ' 18' ' ' GLU . 31.8 t0 -68.02 131.83 46.17 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 p -74.32 146.68 42.91 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.873 0.844 . . . . 0.0 110.127 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.02 -43.01 14.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 117.6 -1.19 . . . . 0.0 111.08 169.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -58.09 -45.62 86.87 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 120.304 1.411 . . . . 0.0 110.979 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -75.05 -33.12 61.7 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 120.742 0.306 . . . . 0.0 110.691 -176.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.33 -50.03 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 124.105 0.962 . . . . 0.0 109.465 170.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -56.46 -36.04 68.59 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 120.303 1.411 . . . . 0.0 110.848 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.58 -35.32 78.78 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.413 1.006 . . . . 0.0 110.248 176.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.5 mttm -66.39 -34.32 77.7 Favored 'General case' 0 C--O 1.22 -0.489 0 O-C-N 120.674 -1.266 . . . . 0.0 109.973 170.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm -65.42 -38.06 81.58 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 120.411 -1.431 . . . . 0.0 109.364 175.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -58.03 -38.08 75.56 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 124.852 1.261 . . . . 0.0 110.076 173.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -63.08 -37.03 85.57 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.925 0.33 . . . . 0.0 111.076 173.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.87 -28.35 16.57 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -169.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -121.18 -34.52 3.48 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 126.363 1.865 . . . . 0.0 113.203 -169.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 104.16 10.58 33.91 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.386 0.993 . . . . 0.0 112.576 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.3 mt -102.79 126.97 31.16 Favored Pre-proline 0 C--N 1.343 0.303 0 CA-C-N 118.688 1.244 . . . . 0.0 108.205 -169.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.79 152.49 80.43 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.771 2.314 . . . . 0.0 111.793 178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.76 -34.26 50.78 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.949 1.766 . . . . 0.0 114.05 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.82 -16.88 62.75 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.614 0.721 . . . . 0.0 111.177 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -102.42 11.44 38.0 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.747 1.619 . . . . 0.0 110.04 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.407 ' HG3' HD21 ' A' ' 69' ' ' LEU . 8.7 tt0 -137.13 147.15 45.81 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 119.649 -1.907 . . . . 0.0 109.601 -168.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -124.11 161.5 25.49 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 170.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 tp -124.56 130.19 51.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.448 HD11 HG11 ' B' ' 695' ' ' VAL . 52.6 mt -121.22 151.42 24.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.67 ' HB3' HD21 ' A' ' 50' ' ' LEU . 37.2 t80 -144.0 121.33 11.61 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 174.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 47.79 34.63 3.99 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 171.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.35 10.43 57.05 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.648 1.118 . . . . 0.0 113.684 174.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -129.83 134.68 47.7 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 118.992 1.396 . . . . 0.0 110.358 171.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 146.45 53.63 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.178 1.391 . . . . 0.0 109.024 172.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 45' ' ' PHE . 10.1 mt -111.33 137.9 48.5 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -98.49 155.93 17.02 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 119.423 1.011 . . . . 0.0 109.693 -175.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -55.53 -38.93 69.91 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.773 1.229 . . . . 0.0 112.186 -169.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.24 10.53 41.89 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 124.697 1.141 . . . . 0.0 114.061 -174.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mmt85 -117.91 179.0 4.21 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.841 1.257 . . . . 0.0 109.141 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 40.3 p -133.09 168.11 19.11 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -173.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.8 mt -61.16 -39.12 88.91 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.879 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.9 p -63.41 -31.44 72.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.361 1.464 . . . . 0.0 113.075 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.57 -20.68 65.84 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.902 0.774 . . . . 0.0 110.831 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.576 ' CG ' HD22 ' A' ' 50' ' ' LEU . 79.7 m-85 -113.01 10.92 18.89 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.919 1.687 . . . . 0.0 112.134 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.57 17.81 8.91 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.396 2.278 . . . . 0.0 113.962 173.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.2 mt -63.77 145.86 13.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 125.693 1.597 . . . . 0.0 107.168 170.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -127.71 -170.84 2.3 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.895 1.278 . . . . 0.0 107.757 177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -59.2 164.01 3.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.192 0.997 . . . . 0.0 111.052 170.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.273 9.0 pt-20 39.3 47.67 1.5 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.216 2.206 . . . . 0.0 110.606 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.8 m -122.28 154.87 37.0 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 114.439 -1.255 . . . . 0.0 108.306 -176.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.3 m -105.61 147.06 28.86 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.264 0.626 . . . . 0.0 109.701 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -132.8 174.43 10.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.462 2.305 . . . . 0.0 108.934 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -125.82 134.28 51.73 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 177.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.8 tm? -104.72 136.25 44.6 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.492 HG12 HD21 ' A' ' 8' ' ' LEU . 2.7 m -130.97 158.56 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.546 HD22 ' H ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -82.89 143.67 30.58 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 169.816 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.97 20.4 3.25 Favored 'General case' 0 C--O 1.221 -0.44 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 171.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 71' ' ' LEU . 1.2 mm? 67.33 -60.78 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.785 1.234 . . . . 0.0 113.835 169.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.91 167.52 20.54 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 126.825 2.05 . . . . 0.0 108.821 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.45 -40.01 0.08 OUTLIER Glycine 0 CA--C 1.533 1.211 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 169.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 N-CA-C 108.376 -1.89 . . . . 0.0 108.376 175.363 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.91 -0.383 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -140.17 159.48 42.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.05 0.94 . . . . 0.0 109.5 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -162.65 173.41 13.93 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.813 2.445 . . . . 0.0 106.625 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . 0.417 ' CD2' ' HD3' ' B' ' 680' ' ' PRO . 15.5 t80 -140.08 -82.61 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.463 0 CA-C-O 116.187 -1.863 . . . . 0.0 108.084 173.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . 0.417 ' HD3' ' CD2' ' B' ' 679' ' ' PHE . 96.1 Cg_endo -75.13 170.22 20.86 Favored 'Trans proline' 0 C--N 1.351 0.681 0 CA-C-N 122.986 2.102 . . . . 0.0 109.232 169.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.5 m -59.41 -17.47 30.84 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.241 1.016 . . . . 0.0 112.695 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.418 ' C ' ' HB ' ' A' ' 9' ' ' THR . 35.6 t70 -64.43 -1.76 1.91 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.437 1.895 . . . . 0.0 114.69 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.649 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.7 mm -129.99 138.72 53.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 119.541 1.064 . . . . 0.0 109.03 -175.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -142.29 138.08 16.25 Favored Pre-proline 0 C--O 1.24 0.559 0 C-N-CA 127.617 2.367 . . . . 0.0 107.872 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -46.55 -40.81 23.71 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.632 2.888 . . . . 0.0 115.987 -178.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -58.7 -52.42 65.75 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 120.63 1.559 . . . . 0.0 110.521 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 15.5 t -71.29 -37.03 64.13 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.197 0 CA-C-O 122.233 1.016 . . . . 0.0 109.898 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -64.69 -22.67 67.03 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.23 1.412 . . . . 0.0 110.593 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -85.94 -30.19 22.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.276 1.43 . . . . 0.0 111.888 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.42 -29.16 67.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.523 1.056 . . . . 0.0 110.411 169.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.65 154.15 93.81 Favored Pre-proline 0 CA--C 1.543 0.686 0 C-N-CA 127.976 2.51 . . . . 0.0 113.099 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -64.83 152.18 83.07 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.559 2.839 . . . . 0.0 110.97 170.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -71.32 -39.19 71.55 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.642 -0.662 . . . . 0.0 110.948 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.51 -39.49 77.52 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.452 -0.78 . . . . 0.0 111.462 -173.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.448 HG11 HD11 ' A' ' 44' ' ' ILE . 2.5 t -74.61 -32.12 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.247 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -58.33 -41.71 85.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.528 1.058 . . . . 0.0 109.155 169.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.62 -45.46 70.11 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.888 0.875 . . . . 0.0 110.725 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.03 -53.62 56.01 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.28 -60.97 3.01 Favored 'General case' 0 C--O 1.213 -0.858 0 C-N-CA 124.913 1.285 . . . . 0.0 109.608 -170.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -59.26 -38.88 81.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 119.377 0.99 . . . . 0.0 111.998 -176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.59 62.18 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.378 0.535 . . . . 0.0 110.643 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.91 -35.27 78.17 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.14 0.576 . . . . 0.0 110.248 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.649 ' CH2' HG21 ' B' ' 683' ' ' ILE . 38.8 m0 -61.77 -48.83 78.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -176.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.5 pttt -72.36 -28.29 62.94 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.707 -0.621 . . . . 0.0 112.449 176.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 73.9 mtt180 -63.49 -49.63 72.81 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.131 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 13.4 p -67.15 -43.71 81.62 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.213 0 C-N-CA 127.388 2.423 . . . . 0.0 113.125 170.688 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptt? . . . . . 0 N--CA 1.5 2.067 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -134.79 157.32 47.05 Favored 'General case' 0 CA--C 1.52 -0.186 0 O-C-N 121.143 -0.973 . . . . 0.0 110.181 173.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pt -142.26 158.43 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.868 0.867 . . . . 0.0 108.805 173.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -112.0 98.87 7.65 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.268 1.427 . . . . 0.0 109.363 -168.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.95 102.0 11.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 120.417 -1.427 . . . . 0.0 107.154 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.6 tttt -68.21 126.39 29.39 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.9 p -81.82 165.58 20.75 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.249 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -62.32 -17.98 60.21 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.385 -1.769 . . . . 0.0 112.259 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.8 t -77.96 -11.43 59.9 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 121.564 1.983 . . . . 0.0 109.329 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.99 36.67 8.23 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.034 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -117.14 122.93 45.47 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 172.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 113.3 25.17 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -96.7 115.62 36.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 m -79.12 141.78 36.99 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.1 pp -142.51 150.99 41.19 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 123.247 0.619 . . . . 0.0 109.336 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -107.38 123.38 48.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.527 0.68 . . . . 0.0 109.608 -172.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 m -151.1 -170.1 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 127.539 2.336 . . . . 0.0 109.204 -169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -124.67 159.49 57.92 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -52.68 -36.24 71.54 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.799 1.666 . . . . 0.0 112.18 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -93.93 10.95 31.28 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.79 -175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.59 138.27 46.7 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 p -77.89 148.4 34.6 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.143 0.973 . . . . 0.0 111.037 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.4 HG13 ' HB3' ' A' ' 50' ' ' LEU . 6.0 mm -48.81 -42.34 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.517 170.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.3 -43.84 83.56 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.731 1.151 . . . . 0.0 110.168 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -76.41 -30.63 57.54 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 122.145 -0.347 . . . . 0.0 111.427 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.518 HG21 HD21 ' A' ' 56' ' ' LEU . 51.3 t -61.25 -52.17 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 O-C-N 121.351 -0.843 . . . . 0.0 108.835 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.06 -34.04 69.69 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.581 -0.7 . . . . 0.0 110.654 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.04 76.92 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 119.802 1.183 . . . . 0.0 111.387 174.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -68.28 -27.2 66.11 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.527 -1.358 . . . . 0.0 110.139 172.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.6 mm -67.52 -41.34 85.8 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.143 0 O-C-N 120.935 -1.103 . . . . 0.0 109.144 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.59 -40.36 75.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 120.681 1.582 . . . . 0.0 109.602 172.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -63.83 -33.3 75.36 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' A' ' 13' ' ' ILE . 51.4 mmtt -96.93 -31.05 12.75 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -173.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -117.5 -30.62 5.47 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.046 1.739 . . . . 0.0 112.754 -168.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.6 4.77 58.01 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.582 1.086 . . . . 0.0 111.939 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.9 mt -90.78 126.13 56.83 Favored Pre-proline 0 CA--C 1.53 0.186 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -169.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -70.15 153.11 67.42 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.844 2.363 . . . . 0.0 111.35 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.13 -29.12 18.01 Favored 'Trans proline' 0 CA--C 1.508 -0.819 0 C-N-CA 121.303 1.335 . . . . 0.0 114.058 -175.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.99 -23.37 67.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 118.485 0.584 . . . . 0.0 110.722 174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -95.92 -13.19 24.09 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 124.008 0.923 . . . . 0.0 111.971 -175.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.8 149.45 39.95 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 120.32 -1.487 . . . . 0.0 107.651 -169.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.452 ' HB3' HG22 ' A' ' 70' ' ' VAL . 1.5 ttt180 -116.24 159.59 21.62 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.5 tp -126.8 128.89 47.28 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.521 HD11 HG11 ' B' ' 695' ' ' VAL . 78.7 mt -120.97 150.35 23.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 106.368 -1.715 . . . . 0.0 106.368 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.475 ' HB3' HD11 ' A' ' 50' ' ' LEU . 32.4 t80 -137.63 123.69 20.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 169.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.47 38.12 5.08 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.76 10.99 60.98 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.82 1.2 . . . . 0.0 113.634 173.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -124.87 165.68 17.62 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.926 1.363 . . . . 0.0 109.036 170.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -104.09 149.65 25.02 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 125.315 1.446 . . . . 0.0 107.525 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -107.83 157.6 18.02 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 118.378 -0.82 . . . . 0.0 109.053 176.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.51 155.2 29.05 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 119.264 0.938 . . . . 0.0 110.394 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -55.03 -38.43 67.93 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 112.666 -168.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 11.35 54.27 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 124.222 0.915 . . . . 0.0 113.762 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -117.85 176.82 5.02 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 118.46 1.13 . . . . 0.0 108.679 -175.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.3 p -131.52 167.69 18.94 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -172.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.518 HD21 HG21 ' A' ' 26' ' ' VAL . 43.9 mt -59.48 -41.06 88.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 109.905 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.9 p -61.18 -33.08 72.87 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 125.625 1.57 . . . . 0.0 113.03 175.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.77 -20.32 65.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.95 0.795 . . . . 0.0 111.078 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CD1' HD12 ' A' ' 50' ' ' LEU . 72.7 m-85 -110.68 9.7 22.82 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.555 1.542 . . . . 0.0 112.02 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.53 16.51 7.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.249 2.22 . . . . 0.0 113.577 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 51.4 mt -64.48 144.44 14.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 170.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -125.04 -169.02 1.91 Allowed 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 125.163 1.385 . . . . 0.0 107.333 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -60.21 163.98 4.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 120.81 -1.181 . . . . 0.0 111.754 172.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 41.95 46.99 3.66 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 112.675 -2.057 . . . . 0.0 109.288 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.5 m -121.01 153.15 37.74 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 -176.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.1 m -104.39 146.25 29.1 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.298 0.639 . . . . 0.0 109.735 -168.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 tp -131.82 173.02 11.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 128.222 2.609 . . . . 0.0 108.622 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -125.74 134.49 51.75 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 118.276 -0.869 . . . . 0.0 108.908 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.71 136.29 45.59 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 170.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 8' ' ' LEU . 2.1 m -130.06 167.47 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -109.15 116.1 31.29 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.568 ' C ' HD12 ' A' ' 73' ' ' LEU . 21.7 ptt180 -102.6 9.05 39.6 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 112.903 174.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 72' ' ' ARG . 1.5 mp 65.68 -48.69 0.39 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.356 1.462 . . . . 0.0 113.078 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -161.35 174.25 13.8 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 125.875 1.67 . . . . 0.0 109.968 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.88 0.17 4.04 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.101 1.334 . . . . 0.0 112.084 174.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.387 0 C-N-CA 125.787 1.66 . . . . 0.0 109.411 175.269 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -142.74 167.83 21.16 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.689 1.196 . . . . 0.0 110.27 -172.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 82.7 mtp -70.33 157.92 36.87 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 169.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.255 61.2 m-85 -121.75 -102.2 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 169.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.04 165.25 31.92 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 CA-C-N 124.35 2.589 . . . . 0.0 106.981 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 5.7 m -57.4 -19.28 22.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.014 0.926 . . . . 0.0 113.158 -177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.17 -7.48 9.2 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 126.931 2.093 . . . . 0.0 115.436 176.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.687 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.5 mm -132.13 137.62 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 119.531 1.06 . . . . 0.0 109.009 -169.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -135.06 137.31 26.72 Favored Pre-proline 0 C--O 1.239 0.518 0 C-N-CA 127.506 2.322 . . . . 0.0 107.518 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.22 -37.94 19.21 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.17 3.247 . . . . 0.0 115.578 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -64.37 -53.27 51.29 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.637 1.108 . . . . 0.0 109.825 -171.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 10.7 t -68.39 -37.85 78.48 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 122.016 0.912 . . . . 0.0 110.118 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -64.52 -18.76 65.12 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 124.576 1.151 . . . . 0.0 111.55 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . 0.402 ' C ' ' H ' ' B' ' 691' ' ' LEU . 11.2 t80 -88.4 -28.61 20.82 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.055 1.342 . . . . 0.0 111.362 169.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.85 8.39 0.27 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.136 2.574 . . . . 0.0 112.032 169.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' B' ' 689' ' ' TYR . 5.6 tp -115.02 153.54 47.13 Favored Pre-proline 0 N--CA 1.449 -0.476 0 C-N-CA 126.859 2.064 . . . . 0.0 112.957 -167.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -64.2 150.52 88.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.363 2.709 . . . . 0.0 111.185 172.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -71.26 -38.79 71.88 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.666 -0.646 . . . . 0.0 111.014 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.52 83.14 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.771 -0.581 . . . . 0.0 111.491 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 44' ' ' ILE . 2.6 t -72.67 -35.35 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -56.16 -42.76 77.53 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.269 0.94 . . . . 0.0 110.041 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.69 -46.98 67.52 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.165 0.986 . . . . 0.0 110.657 177.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.44 -52.52 65.02 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.262 1.029 . . . . 0.0 108.926 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.05 -64.55 0.91 Allowed 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 112.651 -2.068 . . . . 0.0 108.584 -170.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -59.37 -38.65 81.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 118.729 0.695 . . . . 0.0 111.967 -174.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.5 65.47 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -176.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.499 ' CB ' HD13 ' A' ' 73' ' ' LEU . 8.7 mm-40 -65.15 -42.7 93.55 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.587 174.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.687 ' CH2' HG21 ' B' ' 683' ' ' ILE . 50.3 m0 -59.35 -42.85 92.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.444 1.02 . . . . 0.0 109.043 -172.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -82.96 -23.86 33.23 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -71.74 -45.41 61.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.068 0.849 . . . . 0.0 110.007 175.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 60.4 m -86.09 -25.63 25.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 124.947 1.299 . . . . 0.0 109.866 -171.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.268 1.889 . . . . 0.0 111.673 173.215 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ptt? . . . . . 0 N--CA 1.499 2.023 0 N-CA-C 111.344 0.128 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -135.54 156.19 49.28 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.006 -1.059 . . . . 0.0 109.354 175.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.19 157.89 22.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -111.64 97.7 6.91 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 125.05 1.34 . . . . 0.0 108.807 -169.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG21 HD11 ' A' ' 30' ' ' ILE . 27.2 t -84.91 103.99 12.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 O-C-N 119.957 -1.714 . . . . 0.0 106.709 179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.8 tttp -68.77 127.97 34.97 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 170.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 63.7 p -82.07 162.95 22.37 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG12 ' A' ' 70' ' ' VAL . 7.2 mt -60.32 -18.42 49.61 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 116.352 -1.785 . . . . 0.0 112.42 177.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.413 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 7.1 t -74.84 -17.61 60.57 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 122.197 2.271 . . . . 0.0 109.641 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.66 34.71 6.16 Favored Glycine 0 N--CA 1.442 -0.914 0 CA-C-O 118.159 -1.356 . . . . 0.0 111.268 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -117.33 124.19 48.35 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 174.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.27 110.65 22.92 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -93.98 116.59 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -82.0 142.21 32.57 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -143.07 151.93 41.32 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 118.671 -0.68 . . . . 0.0 109.676 176.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.55 124.48 49.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.963 0.789 . . . . 0.0 109.677 -173.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.9 m -150.32 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 127.147 2.179 . . . . 0.0 110.075 -170.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -122.83 155.62 63.25 Favored Pre-proline 0 C--N 1.327 -0.393 0 N-CA-C 106.371 -1.715 . . . . 0.0 106.371 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -53.82 -30.9 59.5 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 121.737 1.624 . . . . 0.0 113.009 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.1 m -93.38 7.41 44.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.598 -1.314 . . . . 0.0 110.267 -177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -73.31 136.76 44.53 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.832 173.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.3 p -74.78 146.97 41.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 122.544 1.164 . . . . 0.0 111.357 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -48.47 -41.27 11.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.044 -1.434 . . . . 0.0 111.826 170.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -58.99 -43.39 91.43 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.406 1.457 . . . . 0.0 110.768 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.04 -29.69 60.85 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 122.286 -0.259 . . . . 0.0 111.48 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.46 HG21 HD21 ' A' ' 56' ' ' LEU . 78.9 t -62.8 -53.85 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 170.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -54.93 -35.64 64.4 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.108 -0.995 . . . . 0.0 111.352 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.57 76.12 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.693 1.133 . . . . 0.0 110.458 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -69.04 -33.14 73.12 Favored 'General case' 0 C--O 1.22 -0.454 0 O-C-N 121.03 -1.044 . . . . 0.0 109.688 171.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.407 HD11 HG21 ' A' ' 5' ' ' VAL . 12.4 mm -63.2 -38.4 82.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 O-C-N 120.321 -1.487 . . . . 0.0 110.016 171.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -58.79 -39.34 80.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 120.586 1.539 . . . . 0.0 109.849 173.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -64.02 -37.41 87.32 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 117.762 0.255 . . . . 0.0 111.022 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.56 -27.07 16.84 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -122.84 -35.63 3.01 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.442 1.897 . . . . 0.0 112.979 -169.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.84 6.97 34.29 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.361 0.981 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 68.2 mt -99.45 127.12 35.25 Favored Pre-proline 0 C--N 1.342 0.266 0 CA-C-N 118.641 1.22 . . . . 0.0 108.906 -169.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -68.39 150.16 75.66 Favored 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.677 2.252 . . . . 0.0 111.901 178.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -65.41 -32.57 49.75 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.892 1.728 . . . . 0.0 114.858 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -71.35 -26.08 62.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 119.033 0.833 . . . . 0.0 109.906 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -84.51 -3.6 58.49 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.709 0.804 . . . . 0.0 111.182 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.285 9.6 tt0 -121.96 139.68 53.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.065 1.346 . . . . 0.0 108.949 -168.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -111.76 152.3 27.98 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.78 1.173 . . . . 0.0 107.852 169.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 tp -121.92 128.63 51.76 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.634 HD11 HG11 ' B' ' 695' ' ' VAL . 36.7 mt -124.06 155.82 31.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 C-N-CA 125.759 1.623 . . . . 0.0 106.893 -177.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 24.6 t80 -145.75 121.83 10.76 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.18 37.47 14.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 169.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.31 15.51 71.5 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -131.36 115.43 16.24 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.165 1.786 . . . . 0.0 107.022 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -64.03 147.91 50.97 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.145 -0.972 . . . . 0.0 108.498 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 11.4 mt -102.34 175.52 5.49 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.81 156.21 46.43 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 119.129 0.877 . . . . 0.0 109.942 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -58.09 -34.58 70.32 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.982 1.313 . . . . 0.0 112.885 -168.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.36 8.32 58.69 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 124.449 1.023 . . . . 0.0 113.778 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -116.14 177.46 4.68 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 118.771 1.285 . . . . 0.0 108.927 -174.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.0 p -131.58 169.56 15.96 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 118.694 0.679 . . . . 0.0 109.99 -173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 26' ' ' VAL . 45.5 mt -58.7 -44.77 90.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.385 177.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -61.23 -31.34 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.938 1.295 . . . . 0.0 112.544 174.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -64.13 -24.41 67.68 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.854 1.207 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.436 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.5 m-85 -105.77 8.2 32.78 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 125.821 1.648 . . . . 0.0 112.543 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.8 m120 59.91 19.6 8.59 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.349 2.26 . . . . 0.0 113.116 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.67 145.29 14.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 169.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -128.68 -169.22 2.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.619 1.168 . . . . 0.0 108.047 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.7 ptmm? -54.37 157.63 2.71 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 124.044 0.938 . . . . 0.0 111.319 170.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 42.82 47.81 4.83 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 126.75 2.02 . . . . 0.0 109.398 172.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 m -120.03 151.44 39.0 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.938 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.3 m -103.9 145.18 30.5 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.31 0.644 . . . . 0.0 109.53 -169.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.5 tp -128.89 177.92 6.75 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.245 2.618 . . . . 0.0 108.704 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.51 140.75 50.5 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.0 0.92 . . . . 0.0 109.072 176.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 0.5 OUTLIER -111.8 134.09 53.59 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 174.099 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.448 HG12 HD21 ' A' ' 8' ' ' LEU . 2.2 m -130.83 166.94 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 169.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.78 131.9 53.97 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -119.97 18.31 12.47 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.569 HD21 ' CD1' ' B' ' 703' ' ' TRP . 1.3 mm? 64.59 -24.68 0.08 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 169.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -65.68 167.31 9.36 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 120.279 1.4 . . . . 0.0 111.541 -174.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.52 39.86 0.18 Allowed Glycine 0 CA--C 1.529 0.93 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 -169.825 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -140.56 154.94 46.71 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.873 1.269 . . . . 0.0 108.096 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 53.3 mtt -79.05 44.57 0.57 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.667 1.187 . . . . 0.0 113.211 -172.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.54 52.22 0.51 Allowed Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.755 2.422 . . . . 0.0 107.415 169.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -74.84 -168.87 0.55 Allowed 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.621 2.881 . . . . 0.0 111.024 -169.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -51.62 -16.88 0.71 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.851 1.66 . . . . 0.0 113.767 170.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.413 ' C ' ' HB ' ' A' ' 9' ' ' THR . 28.2 t70 -56.1 -8.0 0.41 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.763 2.025 . . . . 0.0 114.474 169.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.491 HG21 ' CH2' ' B' ' 703' ' ' TRP . 5.7 mm -134.69 136.79 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.181 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 -172.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -138.88 134.76 17.18 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.844 2.058 . . . . 0.0 108.378 -175.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -47.0 -36.54 20.73 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 124.172 3.248 . . . . 0.0 115.739 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -65.27 -57.67 7.87 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.647 1.112 . . . . 0.0 109.368 -172.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -64.45 -38.02 81.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 CA-C-O 121.904 0.859 . . . . 0.0 109.771 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -62.64 -28.24 69.77 Favored 'General case' 0 N--CA 1.439 -0.98 0 O-C-N 121.83 -0.544 . . . . 0.0 110.673 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -83.97 -24.82 30.45 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.877 1.271 . . . . 0.0 112.95 173.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -61.39 -5.98 2.01 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . 0.404 ' HB2' ' HD2' ' B' ' 692' ' ' PRO . 0.8 OUTLIER -121.83 165.94 18.43 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 124.947 1.299 . . . . 0.0 110.491 -169.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . 0.404 ' HD2' ' HB2' ' B' ' 691' ' ' LEU . 98.2 Cg_endo -64.95 143.2 78.38 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.578 2.185 . . . . 0.0 111.642 -170.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -54.57 -37.78 65.9 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.155 0.582 . . . . 0.0 110.474 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -55.99 -53.47 56.47 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 124.781 1.232 . . . . 0.0 112.118 -179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.634 HG11 HD11 ' A' ' 44' ' ' ILE . 38.3 t -68.67 -33.82 61.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 178.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.65 -44.56 96.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.877 178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . 0.467 0.0 OUTLIER -72.58 -23.6 60.98 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-N 120.386 1.448 . . . . 0.0 112.424 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.13 -53.51 56.2 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 168.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -63.01 1.42 Allowed 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.554 -1.657 . . . . 0.0 108.833 -171.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.6 pp -60.79 -37.4 81.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 119.72 1.145 . . . . 0.0 112.359 -172.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -70.35 -50.33 40.02 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 118.244 0.475 . . . . 0.0 109.822 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.416 ' HB3' ' HG ' ' A' ' 73' ' ' LEU . 7.5 mm-40 -63.88 -35.05 79.37 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 118.821 -0.609 . . . . 0.0 110.635 176.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.569 ' CD1' HD21 ' A' ' 73' ' ' LEU . 41.4 m0 -61.87 -48.82 78.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -175.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -77.34 -30.79 54.11 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -63.4 -48.41 77.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.997 0.817 . . . . 0.0 110.305 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.4 p -70.42 -44.84 67.07 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.294 0 C-N-CA 125.621 1.581 . . . . 0.0 110.52 173.233 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -125.91 155.44 41.28 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.263 0.938 . . . . 0.0 110.515 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 pt -143.18 160.49 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -114.65 97.61 6.38 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 124.557 1.143 . . . . 0.0 108.667 -170.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.4 t -87.82 104.19 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 O-C-N 120.012 -1.68 . . . . 0.0 106.793 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -69.46 127.58 33.5 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 172.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.46 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 76.5 p -81.16 162.95 23.43 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.231 169.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.459 ' HB3' HG23 ' B' ' 683' ' ' ILE . 9.2 mt -60.8 -18.42 55.19 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.624 -1.655 . . . . 0.0 112.0 175.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.431 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 9.7 t -77.84 -11.9 59.93 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 121.451 1.932 . . . . 0.0 109.566 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.58 35.71 8.39 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-O 118.649 -1.084 . . . . 0.0 111.546 -171.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -117.26 123.48 46.7 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.52 115.0 27.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -96.2 111.77 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 175.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -76.0 143.26 41.59 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.38 161.42 39.69 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 118.997 -0.525 . . . . 0.0 109.84 172.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.48 135.91 38.66 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.074 0.94 . . . . 0.0 109.184 176.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -147.31 -172.99 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 126.658 1.983 . . . . 0.0 108.563 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -129.74 155.41 80.45 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 104.492 -2.41 . . . . 0.0 104.492 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.42 -36.37 79.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.154 1.448 . . . . 0.0 111.515 171.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.7 m -92.09 7.81 40.67 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.935 -1.103 . . . . 0.0 110.049 -174.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -68.31 133.39 48.69 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 p -74.14 147.81 42.32 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.559 0.695 . . . . 0.0 109.669 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.2 mm -47.11 -43.54 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 117.397 -1.287 . . . . 0.0 111.686 170.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -57.3 -45.1 84.51 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.744 1.611 . . . . 0.0 110.982 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -77.61 -23.69 49.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.045 0.45 . . . . 0.0 110.934 -175.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.4 t -70.56 -52.31 30.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -54.72 -35.58 63.81 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.677 1.126 . . . . 0.0 111.145 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.23 -39.97 96.12 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 119.188 0.904 . . . . 0.0 110.363 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -64.36 -35.77 81.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.12 -0.988 . . . . 0.0 110.69 171.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.08 -39.5 85.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.967 0 O-C-N 120.767 -1.208 . . . . 0.0 109.93 176.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.27 -38.03 73.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 120.515 1.507 . . . . 0.0 109.9 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.23 -29.58 69.26 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.637 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt -100.58 -22.92 14.81 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 119.224 0.92 . . . . 0.0 113.262 -174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -123.65 -36.24 2.79 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 126.016 1.726 . . . . 0.0 112.703 -170.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 9.93 32.01 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 124.433 1.016 . . . . 0.0 113.087 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 72.5 mt -103.46 126.66 31.48 Favored Pre-proline 0 C--N 1.342 0.275 0 CA-C-N 118.39 1.095 . . . . 0.0 108.484 -169.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.56 150.13 79.91 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.774 2.316 . . . . 0.0 111.506 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -64.53 -33.08 57.99 Favored 'Trans proline' 0 CA--C 1.512 -0.621 0 C-N-CA 122.005 1.804 . . . . 0.0 114.381 -171.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -71.59 -22.37 61.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.747 0.784 . . . . 0.0 110.682 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -91.15 -7.15 52.33 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.189 0.996 . . . . 0.0 111.406 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.44 ' HG3' HD21 ' A' ' 69' ' ' LEU 0.271 9.7 tt0 -115.8 138.7 50.88 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.823 1.649 . . . . 0.0 108.51 -168.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -112.64 155.23 24.79 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.24 0.927 . . . . 0.0 108.844 169.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -124.47 127.27 47.22 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.623 HD11 HG11 ' B' ' 695' ' ' VAL . 43.6 mt -123.84 156.25 30.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' HD21 ' A' ' 50' ' ' LEU . 25.6 t80 -145.52 120.79 10.22 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 46.94 34.99 2.96 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 169.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.08 14.55 54.4 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.555 1.074 . . . . 0.0 113.371 174.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -134.97 136.1 41.95 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 119.305 1.553 . . . . 0.0 110.192 171.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -71.29 150.53 45.08 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 124.728 1.211 . . . . 0.0 108.685 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 45' ' ' PHE . 4.8 mt -103.03 177.78 4.74 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 169.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -135.91 157.36 47.04 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.167 -0.958 . . . . 0.0 109.064 170.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -54.15 -37.81 64.81 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.324 1.85 . . . . 0.0 113.012 -168.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.82 -10.43 86.24 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 123.487 0.565 . . . . 0.0 114.155 -174.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -95.59 178.89 5.32 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 118.335 1.067 . . . . 0.0 109.613 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 38.1 p -128.99 167.98 16.68 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 121.754 -0.591 . . . . 0.0 109.687 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.56 -40.23 93.99 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.762 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.1 p -61.0 -32.13 71.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.749 1.619 . . . . 0.0 112.895 173.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.96 -12.69 61.89 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.139 0.881 . . . . 0.0 111.054 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.45 ' CG ' HD22 ' A' ' 50' ' ' LEU . 70.9 m-85 -116.08 8.01 14.39 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.933 2.093 . . . . 0.0 111.607 175.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.74 19.31 6.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.154 2.582 . . . . 0.0 114.293 177.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.3 mt -63.18 143.56 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 169.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -125.1 -169.05 1.92 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.152 1.381 . . . . 0.0 107.459 176.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.28 167.08 4.37 Favored 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 120.894 -1.129 . . . . 0.0 111.122 172.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.259 7.5 pt-20 38.51 47.49 1.1 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 127.239 2.216 . . . . 0.0 110.503 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.2 m -122.4 152.71 39.93 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.194 -174.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.05 145.9 29.49 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.303 0.641 . . . . 0.0 109.739 -169.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 tp -129.75 178.87 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 127.602 2.361 . . . . 0.0 108.608 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 139.49 50.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.7 tm? -108.46 132.86 53.37 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.427 HG12 HD21 ' A' ' 8' ' ' LEU . 2.0 m -129.3 166.86 25.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 169.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -105.58 129.14 53.9 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.446 ' C ' HD12 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -120.49 20.28 11.87 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 123.978 0.911 . . . . 0.0 112.677 179.699 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.446 HD12 ' C ' ' A' ' 72' ' ' ARG . 2.2 mp 56.87 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 120.122 3.378 . . . . 0.0 120.122 169.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.89 169.54 7.98 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 121.468 1.94 . . . . 0.0 111.542 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -175.69 38.46 0.1 Allowed Glycine 0 CA--C 1.532 1.149 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.331 0 N-CA-C 108.961 -1.656 . . . . 0.0 108.961 -173.193 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 120.91 0.172 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 31.6 m80 53.45 31.45 12.2 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.093 1.757 . . . . 0.0 113.21 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -161.25 141.11 10.64 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.413 2.285 . . . . 0.0 105.467 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -131.93 -85.13 0.0 OUTLIER Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.742 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -74.44 165.87 30.74 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 CA-C-N 123.048 2.124 . . . . 0.0 108.71 169.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 6.2 m -60.56 -11.3 6.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.034 1.334 . . . . 0.0 113.598 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.431 ' C ' ' HB ' ' A' ' 9' ' ' THR . 30.5 t70 -71.61 -4.15 25.48 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.908 2.083 . . . . 0.0 115.128 176.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.58 HG21 ' CH2' ' B' ' 703' ' ' TRP . 3.0 mm -130.98 148.67 33.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -169.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -149.02 138.65 12.77 Favored Pre-proline 0 C--O 1.24 0.568 0 C-N-CA 128.211 2.604 . . . . 0.0 106.181 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.88 -36.53 53.07 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 115.009 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -64.29 -56.28 15.63 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.133 0.879 . . . . 0.0 110.251 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 7.7 t -64.73 -31.44 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 CA-C-O 122.478 1.133 . . . . 0.0 110.088 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -68.07 -33.02 73.76 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.645 -0.659 . . . . 0.0 109.937 -176.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -76.52 -24.04 53.7 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.005 0.922 . . . . 0.0 111.747 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.1 3.12 0.64 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.452 2.301 . . . . 0.0 114.01 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.93 166.45 29.17 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 125.842 1.657 . . . . 0.0 109.939 -172.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -64.95 142.66 76.22 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.847 2.365 . . . . 0.0 111.614 -170.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -57.1 -34.47 68.36 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.798 -0.564 . . . . 0.0 110.864 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.66 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.606 0.762 . . . . 0.0 112.363 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.623 HG11 HD11 ' A' ' 44' ' ' ILE . 21.6 t -72.79 -32.6 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -59.27 -39.88 84.3 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.13 0.877 . . . . 0.0 109.896 171.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -45.11 73.15 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.006 1.322 . . . . 0.0 110.103 176.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.25 -54.44 45.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.933 0.873 . . . . 0.0 108.664 176.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.1 mp -59.24 -64.73 0.84 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 113.266 -1.788 . . . . 0.0 108.855 -170.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.5 -38.16 80.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 119.105 0.866 . . . . 0.0 112.463 -174.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.3 66.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.284 0.493 . . . . 0.0 109.738 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.437 ' CB ' HD13 ' A' ' 73' ' ' LEU . 6.5 mm-40 -66.01 -42.58 89.49 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.921 -0.562 . . . . 0.0 110.479 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.58 ' CH2' HG21 ' B' ' 683' ' ' ILE . 48.2 m0 -59.41 -41.0 88.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.528 0.731 . . . . 0.0 109.977 -173.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -84.29 -24.75 29.74 Favored 'General case' 0 C--N 1.344 0.363 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -65.78 -46.11 79.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 118.555 -0.735 . . . . 0.0 110.508 175.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 28.0 p -69.2 -47.72 64.06 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 C-N-CA 125.793 1.663 . . . . 0.0 111.632 173.261 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptt? . . . . . 0 N--CA 1.497 1.924 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -134.28 154.11 51.48 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 124.179 0.992 . . . . 0.0 110.039 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.4 pt -144.02 154.69 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 172.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -108.73 99.83 9.14 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.191 1.396 . . . . 0.0 109.361 -169.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 t -87.92 102.69 12.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 O-C-N 120.298 -1.502 . . . . 0.0 107.618 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -67.43 125.34 25.84 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.455 ' HA ' ' HB3' ' A' ' 69' ' ' LEU . 74.4 p -81.68 163.46 22.48 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.985 169.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' B' ' 683' ' ' ILE . 12.4 mt -61.25 -17.27 52.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.195 -1.86 . . . . 0.0 111.937 175.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.4 ' HB ' ' C ' ' B' ' 682' ' ' ASP . 12.2 t -79.29 -9.98 59.71 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 121.903 2.138 . . . . 0.0 109.708 -178.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.08 35.17 9.12 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-O 118.636 -1.091 . . . . 0.0 111.504 -171.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -118.62 123.27 44.58 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.26 115.65 28.27 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -98.98 111.58 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 m -76.18 143.98 40.8 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 pp -144.07 154.87 43.68 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -111.04 124.65 52.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.472 0.653 . . . . 0.0 109.569 -174.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 m -150.79 -170.08 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 C-N-CA 127.724 2.41 . . . . 0.0 109.417 -169.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -125.35 157.74 66.62 Favored Pre-proline 0 C--N 1.328 -0.355 0 C-N-CA 125.538 1.535 . . . . 0.0 107.081 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -54.06 -31.85 66.42 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.927 1.752 . . . . 0.0 112.955 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -87.98 2.76 50.96 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 125.51 1.524 . . . . 0.0 110.793 -178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.34 135.68 42.51 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.752 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.7 p -74.92 147.5 40.9 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 122.206 1.003 . . . . 0.0 111.594 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.406 HG13 ' HB3' ' A' ' 50' ' ' LEU . 3.8 mm -53.42 -35.43 24.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.62 172.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.75 -49.93 69.64 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.641 1.11 . . . . 0.0 110.259 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -75.76 -31.27 59.48 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.268 -175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 56' ' ' LEU . 77.9 t -61.42 -56.03 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.174 -0.953 . . . . 0.0 108.524 171.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -54.83 -34.99 63.47 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.57 1.077 . . . . 0.0 112.068 174.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.91 -34.84 78.66 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 119.87 1.214 . . . . 0.0 110.525 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -66.04 -35.1 79.65 Favored 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.02 -1.05 . . . . 0.0 109.354 171.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mm -63.35 -40.27 88.42 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.048 0 O-C-N 120.597 -1.315 . . . . 0.0 110.044 173.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -57.82 -38.85 76.32 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.286 -1.508 . . . . 0.0 109.793 172.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.19 -32.16 73.04 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 119.066 -0.492 . . . . 0.0 111.947 177.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.6 mtpt -99.27 -23.46 15.18 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.187 0.903 . . . . 0.0 113.108 -174.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -123.3 -36.31 2.84 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 126.108 1.763 . . . . 0.0 112.771 -169.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 106.13 5.7 37.51 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 124.49 1.043 . . . . 0.0 112.927 175.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 82.1 mt -96.71 127.51 39.19 Favored Pre-proline 0 C--N 1.342 0.257 0 CA-C-N 118.528 1.164 . . . . 0.0 109.025 -169.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -69.69 148.73 66.17 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.645 2.23 . . . . 0.0 111.767 177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.18 -33.86 59.03 Favored 'Trans proline' 0 CA--C 1.509 -0.736 0 C-N-CA 122.333 2.022 . . . . 0.0 114.943 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -68.26 -26.83 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.878 0.847 . . . . 0.0 110.505 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -88.8 -5.41 58.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.083 0.953 . . . . 0.0 110.976 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . 0.266 10.3 tt0 -112.9 140.54 47.62 Favored 'General case' 0 N--CA 1.444 -0.757 0 C-N-CA 125.981 1.712 . . . . 0.0 109.428 -168.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' HB3' HG22 ' A' ' 70' ' ' VAL . 3.4 ttt180 -114.74 153.91 29.46 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 168.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tp -121.31 129.0 52.88 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.54 -2.392 . . . . 0.0 104.54 178.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.551 HD11 HG11 ' B' ' 695' ' ' VAL . 41.2 mt -114.98 148.33 17.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 178.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -142.76 117.8 10.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 172.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 50.81 33.9 9.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.513 1.125 . . . . 0.0 114.025 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.25 2.17 68.66 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.956 1.265 . . . . 0.0 114.215 177.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -102.53 165.21 11.22 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.8 153.92 43.33 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 118.701 0.682 . . . . 0.0 109.405 169.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.406 ' HB3' HG13 ' A' ' 23' ' ' ILE . 4.8 mp -107.52 166.97 10.27 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.954 -1.475 . . . . 0.0 111.393 -168.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -125.67 153.92 43.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 110.617 171.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.2 -36.1 65.56 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 126.648 1.979 . . . . 0.0 112.631 -168.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.37 7.47 52.9 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.406 1.003 . . . . 0.0 114.187 -175.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -112.57 179.31 4.02 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 124.646 1.178 . . . . 0.0 108.89 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.3 p -131.67 169.11 16.62 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 118.807 0.731 . . . . 0.0 110.285 -177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD21 HG21 ' A' ' 26' ' ' VAL . 41.6 mt -57.92 -44.9 87.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 175.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.2 m -60.43 -30.76 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.807 1.243 . . . . 0.0 112.769 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.3 -24.72 66.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.895 1.225 . . . . 0.0 110.965 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -104.37 10.34 35.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.727 1.611 . . . . 0.0 111.982 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.29 18.55 6.76 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.801 2.44 . . . . 0.0 113.943 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.2 mt -63.8 144.37 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 125.687 1.595 . . . . 0.0 107.144 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -125.62 -169.63 2.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.117 1.367 . . . . 0.0 107.685 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -62.74 165.76 6.21 Favored 'General case' 0 CA--C 1.515 -0.39 0 O-C-N 121.171 -0.956 . . . . 0.0 111.543 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.266 7.8 pt-20 40.06 46.35 1.8 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.129 2.171 . . . . 0.0 110.448 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.3 m -120.35 154.05 35.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -175.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 m -104.95 145.1 30.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.561 0.696 . . . . 0.0 109.157 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 tp -130.78 173.24 11.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.089 2.555 . . . . 0.0 108.413 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 m80 -128.65 135.89 49.9 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 7' ' ' THR . 1.2 tm? -106.03 135.45 47.46 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 173.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.489 HG22 ' HB3' ' A' ' 42' ' ' ARG . 2.6 m -132.79 164.96 33.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 169.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.04 115.08 29.56 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 73' ' ' LEU . 7.8 ptm180 -104.58 10.86 34.8 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.362 176.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.574 HD12 ' C ' ' A' ' 72' ' ' ARG . 1.7 mp 66.26 -42.96 0.39 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.233 1.413 . . . . 0.0 114.019 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -164.74 166.15 20.14 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.505 1.522 . . . . 0.0 110.162 -171.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.6 26.21 3.35 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.679 1.133 . . . . 0.0 111.685 174.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 125.834 1.683 . . . . 0.0 109.048 176.421 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.691 0 N-CA-C 113.804 0.282 . . . . 0.0 113.804 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -2' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -130.17 169.65 15.08 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.173 0.989 . . . . 0.0 108.638 -174.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -139.97 156.7 46.52 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 128.102 2.561 . . . . 0.0 104.376 171.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 679' ' ' PHE . . . . . . . . . . . . 0.259 62.9 m-85 -122.72 -91.47 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-O 115.659 -2.115 . . . . 0.0 107.609 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 680' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.29 161.4 46.13 Favored 'Trans proline' 0 C--N 1.352 0.738 0 CA-C-N 123.512 2.29 . . . . 0.0 108.621 169.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 681' ' ' SER . . . . . . . . . . . . . 7.0 m -58.78 -15.75 13.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.257 1.023 . . . . 0.0 112.673 177.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 682' ' ' ASP . . . . . 0.4 ' C ' ' HB ' ' A' ' 9' ' ' THR . 27.0 t70 -60.74 -6.95 1.96 Allowed 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 127.962 2.505 . . . . 0.0 115.538 174.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 683' ' ' ILE . . . . . 0.601 HG21 ' CH2' ' B' ' 703' ' ' TRP . 2.6 mm -131.01 142.47 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 119.732 1.151 . . . . 0.0 109.124 -169.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -147.34 140.99 15.34 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 127.577 2.351 . . . . 0.0 108.091 -176.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 685' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -50.64 -37.81 54.12 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.662 2.908 . . . . 0.0 115.149 -176.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 686' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -58.68 -56.82 17.24 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 120.103 1.32 . . . . 0.0 109.61 -172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 687' ' ' VAL . . . . . . . . . . . . . 12.9 t -71.51 -37.94 66.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.98 0.895 . . . . 0.0 110.101 -174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 688' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -63.41 -20.41 65.52 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 124.65 1.18 . . . . 0.0 111.356 176.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 689' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -89.65 -28.47 19.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.079 1.352 . . . . 0.0 111.307 170.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 690' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -64.25 -5.19 4.58 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.318 2.247 . . . . 0.0 111.696 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 5.5 tp -97.81 153.57 38.18 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 127.646 2.379 . . . . 0.0 112.746 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 692' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -64.8 150.64 87.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.571 2.847 . . . . 0.0 111.046 171.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 693' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -72.3 -37.23 69.03 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.842 -0.536 . . . . 0.0 110.971 -174.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.89 -40.13 75.86 Favored 'General case' 0 N--CA 1.464 0.225 0 O-C-N 121.57 -0.706 . . . . 0.0 111.411 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 695' ' ' VAL . . . . . 0.551 HG11 HD11 ' A' ' 44' ' ' ILE . 3.3 t -73.34 -34.6 44.02 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 O-C-N 121.318 -0.864 . . . . 0.0 108.876 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 696' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -55.85 -41.8 74.87 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 119.498 1.045 . . . . 0.0 109.801 169.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.85 -46.96 68.06 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.036 0.934 . . . . 0.0 111.155 176.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 698' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -56.61 -54.87 41.01 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 699' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.66 -64.4 0.91 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.417 -169.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.76 -39.24 88.02 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.992 0.815 . . . . 0.0 112.355 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.65 -49.76 50.58 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.657 0.662 . . . . 0.0 109.648 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 702' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 73' ' ' LEU . 45.8 mm-40 -62.48 -44.89 95.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.25 173.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 703' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' B' ' 683' ' ' ILE . 47.8 m0 -57.95 -47.03 84.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.79 1.177 . . . . 0.0 109.085 -172.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 704' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -78.53 -26.11 45.7 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 705' ' ' ARG . . . . . . . . . . . . . 59.2 mtp180 -73.05 -43.26 62.2 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.825 0.739 . . . . 0.0 110.428 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 706' ' ' THR . . . . . . . . . . . . . 31.3 m -88.95 -25.55 22.01 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.882 1.273 . . . . 0.0 109.967 -169.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.26 0 C-N-CA 126.423 1.963 . . . . 0.0 111.862 172.586 . . . . . . . . 0 0 . 1 stop_ save_