data_2lxx_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 2lxx _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.621 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.420000000000002 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.200000000000003 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.140000000000001 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.209999999999994 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 74.549999999999997 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.310000000000002 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.209999999999994 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.481 ' HB3' ' HG ' ' A' ' 11' ' ' CYS . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.450000000000003 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.450000000000003 113.069 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 64.140000000000001 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.746 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.230000000000004 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.230000000000004 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.450000000000003 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.230000000000004 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.340000000000003 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 73.310000000000002 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.420000000000002 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.509 HD13 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.120000000000005 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.509 ' N ' HD13 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 71.329999999999998 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.209999999999994 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 74.049999999999997 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.299999999999997 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.530000000000001 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.451 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.430000000000007 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.5 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 71.310000000000002 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 73.430000000000007 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.549999999999997 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.746 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.616 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.4 ' N ' HD13 ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.109999999999999 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 64.430000000000007 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.310000000000002 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.010000000000005 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.451 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.219999999999999 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.399999999999999 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.299999999999997 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 74.140000000000001 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.483 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.239999999999995 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 HD12 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 72.400000000000006 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.616 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 61.43 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB3' HD13 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 75.109999999999999 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 74.409999999999997 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.454 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 73.400000000000006 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.409999999999997 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.219999999999999 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 71.310000000000002 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 71.450000000000003 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 71.200000000000003 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.540000000000006 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.319999999999993 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 74.319999999999993 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 74.340000000000003 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.239999999999995 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 74.040000000000006 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.129999999999995 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.109999999999999 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.099999999999994 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 72.540000000000006 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.040000000000006 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 72.540000000000006 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.209999999999994 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 52.020000000000003 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.230000000000004 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.601 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 73.510000000000005 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.658 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 72.019999999999996 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.601 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.120000000000005 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.743 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.510000000000005 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 45.43 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 62.299999999999997 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.530000000000001 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.340000000000003 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 73.109999999999999 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 72.439999999999998 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.573 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.150000000000006 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 75.430000000000007 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.794 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 73.150000000000006 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.129999999999995 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.449 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 21.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 70.150000000000006 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 72.420000000000002 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.209999999999994 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 73.310000000000002 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.439999999999998 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.349999999999994 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.794 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.430000000000007 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.469 HG21 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.439999999999998 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 74.439999999999998 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.569 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.109999999999999 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.546 HG12 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.430000000000007 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.54 ' HB ' HD11 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.340000000000003 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 72.450000000000003 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 74.329999999999998 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 75.109999999999999 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 63.130000000000003 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.624 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 71.140000000000001 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 64.430000000000007 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.230000000000004 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 71.439999999999998 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.430000000000007 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 73.140000000000001 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.518 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.349999999999994 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.658 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.230000000000004 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 75.439999999999998 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.510000000000005 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 73.239999999999995 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 74.049999999999997 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.621 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.130000000000003 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.532 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.530000000000001 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.525 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 72.310000000000002 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 73.430000000000007 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.404 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.109999999999999 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.229999999999997 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.582 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 75.209999999999994 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.482 ' N ' HD13 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 75.230000000000004 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 75.439999999999998 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.420000000000002 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.582 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 74.430000000000007 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.439999999999998 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.701 ' HA ' HD22 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 75.299999999999997 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.120000000000005 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 65.140000000000001 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.701 HD22 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.299999999999997 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.430000000000007 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 64.549999999999997 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.549999999999997 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.030000000000001 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 63.140000000000001 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.624 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.040000000000006 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.140000000000001 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.109999999999999 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 55.240000000000002 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.299999999999997 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.150000000000006 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.219999999999999 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 75.5 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 72.019999999999996 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.299999999999997 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.209999999999994 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 71.430000000000007 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.430000000000007 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.299999999999997 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.522 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.340000000000003 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 74.200000000000003 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . 0.491 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 72.310000000000002 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.573 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 70.219999999999999 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 75.439999999999998 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . 0.491 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.802 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.439999999999998 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 60.25 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.099999999999994 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 65.140000000000001 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.540000000000006 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.239999999999995 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.457 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.420000000000002 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.519999999999996 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.109999999999999 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.450000000000003 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.400000000000006 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 73.25 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.230000000000004 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.596 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 75.120000000000005 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.799 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.430000000000007 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.520000000000003 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 72.140000000000001 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.799 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 62.32 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.420000000000002 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.534 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 74.430000000000007 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.400000000000006 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.439999999999998 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.636 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.510000000000005 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.715 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.530000000000001 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.673 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.209999999999994 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 75.319999999999993 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.608 HG21 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 75.219999999999999 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.714 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.349999999999994 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.943 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 75.439999999999998 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.329999999999998 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.943 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.439999999999998 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.95 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 73.310000000000002 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.519999999999996 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.95 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.450000000000003 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.497 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 73.409999999999997 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.585 ' HB1' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.430000000000007 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.458 HD11 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.549999999999997 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 73.349999999999994 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 75.239999999999995 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.845 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.319999999999993 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 73.400000000000006 110.743 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.450000000000003 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.657 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.239999999999995 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.040000000000006 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.715 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 72.140000000000001 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.340000000000003 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB1' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.530000000000001 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.299999999999997 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.573 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 73.519999999999996 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.209999999999994 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 73.329999999999998 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.657 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 74.209999999999994 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.340000000000003 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.109999999999999 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.66 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.420000000000002 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.409999999999997 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.415 ' C ' ' HD2' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 75.299999999999997 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.140000000000001 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 70.030000000000001 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 74.510000000000005 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.528 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.109999999999999 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.209999999999994 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 71.129999999999995 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.519999999999996 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.439999999999998 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.555 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 70.329999999999998 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HB3' HG21 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.430000000000007 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.714 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.319999999999993 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.530000000000001 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 64.230000000000004 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.673 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 74.530000000000001 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.675 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.439999999999998 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.329999999999998 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.310000000000002 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.439999999999998 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 75.430000000000007 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 73.319999999999993 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.230000000000004 110.136 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 73.150000000000006 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 74.340000000000003 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.540000000000006 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 74.310000000000002 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.510000000000005 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.329999999999998 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.349999999999994 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.400000000000006 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 73.239999999999995 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.51 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.019999999999996 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.4 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.209999999999994 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.019999999999996 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.675 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 75.519999999999996 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.502 HD11 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 73.040000000000006 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.505 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.349999999999994 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.230000000000004 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.549999999999997 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 71.450000000000003 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.587 ' HG2' ' HB1' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 75.409999999999997 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.109999999999999 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.587 ' HB1' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.049999999999997 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.467 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 75.120000000000005 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.239999999999995 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.555 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.219999999999999 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.467 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.430000000000007 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.420000000000002 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 74.349999999999994 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.319999999999993 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.428 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 74.010000000000005 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.329999999999998 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.524 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 72.409999999999997 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.519999999999996 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.802 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.439999999999998 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.430000000000007 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.47 HD13 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.549999999999997 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 75.209999999999994 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 54.009999999999998 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.200000000000003 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 74.150000000000006 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 71.239999999999995 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.64 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.409999999999997 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.509 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 74.349999999999994 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.509 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.439999999999998 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 72.299999999999997 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 74.150000000000006 110.619 -174.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.505 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.319999999999993 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 60.229999999999997 110.514 -175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 75.409999999999997 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.457 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 55.200000000000003 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.430000000000007 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.010000000000005 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 71.219999999999999 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.299999999999997 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 71.239999999999995 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 72.209999999999994 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.540000000000006 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.349999999999994 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.329999999999998 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' SER . . . . . 0.644 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 44.340000000000003 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 74.439999999999998 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.239999999999995 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 75.030000000000001 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.040000000000006 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.53 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 72.519999999999996 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.446 ' N ' HD13 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 71.129999999999995 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 73.120000000000005 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 71.25 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 75.109999999999999 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.040000000000006 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 74.040000000000006 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.664 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.540000000000006 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 61.32 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.310000000000002 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.349999999999994 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.667 HG23 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.549999999999997 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 74.409999999999997 111.388 -176.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.120000000000005 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 54.539999999999999 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 74.340000000000003 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.340000000000003 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.109999999999999 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HZ2' ' CG ' ' A' ' 16' ' ' ASP . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 73.150000000000006 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.418 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 73.310000000000002 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.578 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 74.099999999999994 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.446 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.340000000000003 110.849 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 75.019999999999996 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.530000000000001 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 72.319999999999993 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.310000000000002 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.439999999999998 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.129999999999995 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 75.129999999999995 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.310000000000002 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.039999999999999 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.415 ' HB3' HG22 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.040000000000006 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.406 HD13 HG23 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.049999999999997 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.329999999999998 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.747 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 74.230000000000004 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.895 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 75.310000000000002 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 73.0 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.781 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 73.310000000000002 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.848 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.099999999999994 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.409999999999997 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.430000000000007 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.848 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 62.009999999999998 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.72 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 64.409999999999997 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 73.209999999999994 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.407 HG12 HG11 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 71.310000000000002 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.667 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 64.439999999999998 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 74.140000000000001 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.407 HG11 HG12 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 73.140000000000001 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.299999999999997 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.430000000000007 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 1.053 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.209999999999994 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 63.439999999999998 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 73.319999999999993 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.420000000000002 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.530000000000001 110.478 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 51.539999999999999 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.514 ' HZ ' ' HB2' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 74.340000000000003 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 73.219999999999999 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 71.25 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.239999999999995 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.519999999999996 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.409999999999997 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.049999999999997 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.219999999999999 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.419 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.329999999999998 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 64.400000000000006 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.310000000000002 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.120000000000005 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 74.329999999999998 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.467 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.049999999999997 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 72.230000000000004 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.895 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 74.510000000000005 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.747 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.099999999999994 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HB2' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 70.319999999999993 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.340000000000003 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 73.200000000000003 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 73.120000000000005 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 73.219999999999999 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.834 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.019999999999996 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 75.109999999999999 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.129999999999995 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 75.099999999999994 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.656 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.430000000000007 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.656 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.439999999999998 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 74.329999999999998 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.400000000000006 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 53.450000000000003 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.140000000000001 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 72.109999999999999 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 75.310000000000002 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.519999999999996 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 72.200000000000003 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.47 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.834 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.340000000000003 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 72.409999999999997 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.561 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.439999999999998 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.530000000000001 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.638 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 74.239999999999995 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 74.299999999999997 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.109999999999999 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 74.510000000000005 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.099999999999994 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.239999999999995 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 74.5 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.641 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.430000000000007 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.209999999999994 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.319999999999993 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.641 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 73.319999999999993 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.510000000000005 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 71.310000000000002 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.423 ' O ' HG22 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 62.030000000000001 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 71.010000000000005 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.299999999999997 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG23 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 74.420000000000002 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.25 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.443 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 75.430000000000007 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.209999999999994 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 73.420000000000002 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 75.010000000000005 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 64.150000000000006 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 74.239999999999995 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.420000000000002 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.510000000000005 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.030000000000001 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.239999999999995 112.37 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.340000000000003 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 71.310000000000002 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 75.329999999999998 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.638 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 74.340000000000003 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 74.129999999999995 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.310000000000002 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.42 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 64.230000000000004 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.209999999999994 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.658 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.439999999999998 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 74.430000000000007 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' SER . . . . . 0.534 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.109999999999999 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.658 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 63.119999999999997 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.771 ' H ' HD11 ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.329999999999998 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 70.310000000000002 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.109999999999999 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 75.450000000000003 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 72.040000000000006 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 75.540000000000006 112.302 -171.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.400000000000006 111.208 -175.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.310000000000002 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.420000000000002 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.319999999999993 110.682 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 74.5 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.230000000000004 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . 0.516 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.219999999999999 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 75.319999999999993 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.430000000000007 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . 0.554 HD12 ' OXT' ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 75.420000000000002 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.617 ' HG2' ' HB2' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 73.209999999999994 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.319999999999993 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 63.130000000000003 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.140000000000001 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 75.209999999999994 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.507 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.019999999999996 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 72.329999999999998 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 74.409999999999997 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.405 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.349999999999994 110.047 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.439999999999998 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.441 ' C ' HD21 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 73.219999999999999 109.618 175.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.329999999999998 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.443 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 74.510000000000005 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.120000000000005 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.120000000000005 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 73.409999999999997 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 74.409999999999997 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 74.329999999999998 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.784 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 74.219999999999999 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.019999999999996 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.319999999999993 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 75.5 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.678 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.340000000000003 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 73.299999999999997 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 72.109999999999999 109.236 171.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.439999999999998 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.625 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.230000000000004 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 71.400000000000006 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.129999999999995 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.340000000000003 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 74.25 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.491 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 72.430000000000007 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.519999999999996 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.120000000000005 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.419 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 75.140000000000001 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.240000000000002 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.140000000000001 110.501 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.299999999999997 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 73.040000000000006 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.400000000000006 109.384 177.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.340000000000003 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.678 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 74.530000000000001 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 75.030000000000001 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 73.129999999999995 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 74.310000000000002 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.529 ' O ' HG22 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 71.340000000000003 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.329999999999998 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.140000000000001 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.687 ' HZ ' ' HB3' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 65.310000000000002 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.219999999999999 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 73.129999999999995 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.84 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 74.409999999999997 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.47 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 73.439999999999998 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.239999999999995 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.84 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 73.239999999999995 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.563 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 74.540000000000006 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.489 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 64.209999999999994 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.409999999999997 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 61.450000000000003 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 71.129999999999995 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 74.140000000000001 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.489 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.150000000000006 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 72.25 108.414 171.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.563 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 75.219999999999999 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.625 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.687 ' HB3' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 63.020000000000003 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.319999999999993 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.555 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.439999999999998 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.239999999999995 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.798 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 72.109999999999999 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.310000000000002 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.349999999999994 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.319999999999993 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 60.310000000000002 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 75.340000000000003 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 75.140000000000001 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.450000000000003 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.746 ' HB2' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.010000000000005 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 72.430000000000007 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.340000000000003 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.519999999999996 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.746 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 74.239999999999995 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.61 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 72.019999999999996 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.403 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 74.230000000000004 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.798 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.420000000000002 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 73.409999999999997 110.483 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 73.010000000000005 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 73.409999999999997 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.604 ' HE2' HD13 ' A' ' 117' ' ' LEU . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 75.099999999999994 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.200000000000003 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.120000000000005 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 71.510000000000005 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.200000000000003 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 64.099999999999994 112.125 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.450000000000003 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.209999999999994 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.608 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.310000000000002 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.568 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.510000000000005 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.43 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.239999999999995 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 75.219999999999999 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.329999999999998 111.077 -176.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.669 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.340000000000003 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.540000000000006 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.209999999999994 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.669 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.439999999999998 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.617 ' HB2' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 71.219999999999999 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 73.510000000000005 111.361 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.597 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.099999999999994 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.109999999999999 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 73.219999999999999 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.530000000000001 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.604 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.409999999999997 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.536 ' N ' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.200000000000003 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 72.439999999999998 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . 0.507 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.109999999999999 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.129999999999995 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 71.439999999999998 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 53.130000000000003 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 74.400000000000006 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 75.299999999999997 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.349999999999994 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.593 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 74.120000000000005 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 65.400000000000006 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.450000000000003 111.36 -177.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.109999999999999 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 64.409999999999997 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.400000000000006 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.530000000000001 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 74.420000000000002 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.409999999999997 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.109999999999999 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 74.510000000000005 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 74.010000000000005 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.140000000000001 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 75.239999999999995 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.540000000000006 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.140000000000001 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.400000000000006 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 75.230000000000004 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 70.319999999999993 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.415 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.400000000000006 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.430000000000007 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . 0.4 HD13 ' OXT' ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 62.119999999999997 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.409999999999997 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.530000000000001 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 55.200000000000003 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.150000000000006 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.120000000000005 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.319999999999993 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 62.340000000000003 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.319999999999993 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.425 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 73.25 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 73.340000000000003 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 74.510000000000005 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.605 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 63.350000000000001 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 73.049999999999997 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.120000000000005 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.713 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 61.100000000000001 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 75.430000000000007 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.713 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.400000000000006 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.239999999999995 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.400000000000006 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.530000000000001 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.310000000000002 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.519999999999996 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 73.010000000000005 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 75.219999999999999 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.49 HD12 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.420000000000002 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.507 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.329999999999998 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.549 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.230000000000004 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.517 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 64.540000000000006 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 72.310000000000002 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.69 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.030000000000001 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.409999999999997 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.439999999999998 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.329999999999998 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.420000000000002 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 72.150000000000006 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.507 HD12 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.230000000000004 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.626 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 74.510000000000005 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.49 HG13 HD12 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.099999999999994 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.517 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 73.209999999999994 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 73.439999999999998 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.420000000000002 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 74.540000000000006 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.040000000000006 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 64.349999999999994 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.519999999999996 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.43 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.420000000000002 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 70.319999999999993 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.468 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 71.019999999999996 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 73.030000000000001 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.120000000000005 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 71.519999999999996 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 71.420000000000002 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.430000000000007 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.030000000000001 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.4 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 75.439999999999998 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 73.439999999999998 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.56 ' HZ1' ' HB2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 73.349999999999994 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.44 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 75.120000000000005 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 72.120000000000005 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.472 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.430000000000007 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.439999999999998 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.430000000000007 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.319999999999993 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.443 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 73.129999999999995 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.530000000000001 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.619 ' HE ' ' HA ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.5 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.239999999999995 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 74.209999999999994 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.129999999999995 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.707 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.209999999999994 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.209999999999994 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 72.109999999999999 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.534 HG13 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.400000000000006 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 73.099999999999994 110.67 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.555 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 73.420000000000002 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 75.519999999999996 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 74.540000000000006 110.517 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 70.129999999999995 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.329999999999998 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.420000000000002 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 61.539999999999999 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 73.409999999999997 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.530000000000001 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.555 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 75.25 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 75.239999999999995 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.528 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.120000000000005 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.510000000000005 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.707 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.519999999999996 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.671 HD13 HG22 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 70.049999999999997 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.674 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 74.219999999999999 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 74.510000000000005 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 72.340000000000003 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.120000000000005 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.299999999999997 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.019999999999996 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.48 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.049999999999997 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.472 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 73.329999999999998 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.340000000000003 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.439999999999998 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 75.150000000000006 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.430000000000007 110.399 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 70.409999999999997 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 72.439999999999998 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.329999999999998 110.688 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.120000000000005 110.954 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.519999999999996 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.493 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.439999999999998 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 75.530000000000001 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.402 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.519999999999996 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.120000000000005 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB3' HD12 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.120000000000005 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.499 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.430000000000007 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 73.120000000000005 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.409999999999997 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.492 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 75.450000000000003 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.229999999999997 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.742 ' HA ' HD21 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.450000000000003 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.510000000000005 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 72.420000000000002 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 72.299999999999997 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.48 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.540000000000006 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.510000000000005 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.671 HG22 HD13 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.439999999999998 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.468 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 74.540000000000006 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.442 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 75.129999999999995 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.406 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.219999999999999 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 72.319999999999993 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' SER . . . . . 0.415 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.140000000000001 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.442 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.319999999999993 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.310000000000002 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.219999999999999 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 75.540000000000006 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.519999999999996 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.455 HG22 HG12 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 74.450000000000003 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.310000000000002 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' SER . . . . . 0.508 ' HA ' ' HE3' ' A' ' 147' ' ' MET . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.129999999999995 111.479 -178.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.129999999999995 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.534 ' HG3' HG13 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.239999999999995 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.530000000000001 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 74.140000000000001 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.528 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.129999999999995 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 72.310000000000002 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.675 ' HG2' ' HB2' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 74.239999999999995 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 73.349999999999994 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.449 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 73.319999999999993 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 55.140000000000001 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.763 HG12 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.549999999999997 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 64.0 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.574 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.019999999999996 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.140000000000001 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 72.209999999999994 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.099999999999994 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.130000000000003 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.25 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 72.109999999999999 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 64.450000000000003 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.445 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.219999999999999 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.530000000000001 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.099999999999994 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.654 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.400000000000006 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.310000000000002 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.150000000000006 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.349999999999994 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.654 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.420000000000002 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.448 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.340000000000003 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.456 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 72.219999999999999 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 71.319999999999993 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.467 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.140000000000001 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.049999999999997 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.472 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 74.329999999999998 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.040000000000006 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.439999999999998 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.525 HD11 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.019999999999996 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.519999999999996 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.74 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 74.400000000000006 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 74.219999999999999 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.74 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 75.200000000000003 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.763 ' HB ' HG12 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.019999999999996 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.519999999999996 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.581 HD11 HD21 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.140000000000001 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 71.150000000000006 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.030000000000001 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.420000000000002 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 75.540000000000006 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.46 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.299999999999997 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.420000000000002 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.576 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 71.150000000000006 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 71.109999999999999 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 64.329999999999998 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.209999999999994 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' HG22 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 70.409999999999997 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 75.209999999999994 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 62.130000000000003 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 74.099999999999994 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.319999999999993 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.230000000000004 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.310000000000002 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.411 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.319999999999993 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.510000000000005 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.41 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 74.310000000000002 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.230000000000004 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 65.129999999999995 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.129999999999995 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.349999999999994 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.399999999999999 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.400000000000006 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 72.25 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.020000000000003 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.472 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 71.540000000000006 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.509999999999998 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.425 ' HB2' ' HZ ' ' A' ' 53' ' ' PHE . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.040000000000006 112.083 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 53.439999999999998 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.455 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.519999999999996 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.439 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.549999999999997 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 65.140000000000001 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.793 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 71.140000000000001 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 74.409999999999997 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 74.120000000000005 111.328 -175.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 79' ' ' GLN . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 74.349999999999994 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.417 ' H ' HG12 ' A' ' 78' ' ' VAL . 33.3 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 72.209999999999994 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.530000000000001 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.519999999999996 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 74.340000000000003 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.140000000000001 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.010000000000005 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.209999999999994 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.450000000000003 109.748 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 74.340000000000003 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 75.209999999999994 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.793 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.420000000000002 110.284 176.354 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.57 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 75.540000000000006 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.340000000000003 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 72.310000000000002 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.629 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 72.329999999999998 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 72.239999999999995 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.49 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 75.010000000000005 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.469 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 74.329999999999998 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.439999999999998 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.109999999999999 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.120000000000005 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.129999999999995 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.209999999999994 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.540000000000006 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.439999999999998 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.409999999999997 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 74.549999999999997 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.299999999999997 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 70.120000000000005 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HB3' HD11 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.439999999999998 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.430000000000007 110.559 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.675 ' HB2' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.430000000000007 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.409999999999997 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.340000000000003 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.540000000000006 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.230000000000004 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.420000000000002 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.120000000000005 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.019999999999996 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.299999999999997 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 74.019999999999996 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.584 HD21 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.049999999999997 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 74.310000000000002 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.120000000000005 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.340000000000003 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 75.129999999999995 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.319999999999993 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.510000000000005 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.629 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.439999999999998 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.329999999999998 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.49 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.200000000000003 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 70.040000000000006 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.519999999999996 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.409999999999997 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.532 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 64.129999999999995 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 74.0 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 74.239999999999995 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 71.200000000000003 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 73.120000000000005 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.501 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.349999999999994 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 74.420000000000002 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 50.32 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 74.319999999999993 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 75.349999999999994 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.140000000000001 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.239999999999995 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.452 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 75.140000000000001 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.310000000000002 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.340000000000003 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.57 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 73.409999999999997 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . 0.616 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 74.439999999999998 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 71.209999999999994 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.597 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.230000000000004 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.319999999999993 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 73.519999999999996 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 73.310000000000002 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.319999999999993 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.209999999999994 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 75.519999999999996 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 74.400000000000006 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 72.239999999999995 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.509999999999998 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.524 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.519999999999996 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.349999999999994 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 73.340000000000003 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.628 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 74.230000000000004 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 73.129999999999995 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.540000000000006 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 74.549999999999997 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.409999999999997 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 75.099999999999994 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 74.340000000000003 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 75.340000000000003 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 72.329999999999998 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.812 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.129999999999995 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.349999999999994 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.644 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.109999999999999 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.611 HD12 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 75.239999999999995 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.420000000000002 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.524 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.109999999999999 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.612 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 65.329999999999998 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 65.530000000000001 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.602 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.239999999999995 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 73.409999999999997 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.219999999999999 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.520000000000003 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.310000000000002 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.481 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 72.340000000000003 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.73 HD11 HD21 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.140000000000001 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.239999999999995 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.611 HG22 HD12 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.349999999999994 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 73.340000000000003 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.798 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 73.030000000000001 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.340000000000003 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 62.039999999999999 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.442 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 73.140000000000001 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.442 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.129999999999995 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.040000000000006 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HB1' ' HH ' ' A' ' 26' ' ' TYR . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 72.140000000000001 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.400000000000006 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HH ' HG23 ' A' ' 74' ' ' VAL . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 74.439999999999998 110.814 178.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 74.219999999999999 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.239999999999995 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 75.409999999999997 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.62 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.420000000000002 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.798 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.319999999999993 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.299999999999997 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.62 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.549999999999997 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.519999999999996 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 75.420000000000002 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.030000000000001 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.583 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.150000000000006 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.219999999999999 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 71.040000000000006 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 72.239999999999995 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.030000000000001 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.438 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 71.329999999999998 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.612 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 75.230000000000004 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HH ' ' HG3' ' A' ' 128' ' ' GLN . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.420000000000002 108.661 175.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 70.420000000000002 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 71.230000000000004 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.614 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.239999999999995 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.838 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.210000000000001 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.501 HG23 ' HH ' ' A' ' 50' ' ' TYR . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.129999999999995 109.706 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.614 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.430000000000007 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.42 ' HB ' HE22 ' A' ' 150' ' ' GLN . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.340000000000003 109.719 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 74.409999999999997 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 72.219999999999999 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.049999999999997 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 75.530000000000001 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.040000000000006 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.099999999999994 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 73.219999999999999 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.099999999999994 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.496 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.219999999999999 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.109999999999999 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.209999999999994 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 70.209999999999994 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.458 HD23 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.109999999999999 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.614 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.530000000000001 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.497 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 74.120000000000005 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.838 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.120000000000005 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 75.340000000000003 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.469 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.340000000000003 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 71.310000000000002 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.430000000000007 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.476 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.519999999999996 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 75.299999999999997 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 71.150000000000006 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.430000000000007 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.427 ' HB2' ' HG2' ' A' ' 107' ' ' ARG . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 74.209999999999994 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.672 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 71.239999999999995 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 65.099999999999994 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.319999999999993 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.319999999999993 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 75.099999999999994 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 74.109999999999999 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.150000000000006 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.329999999999998 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.530000000000001 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.239999999999995 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.129999999999995 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.510000000000005 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.530000000000001 111.05 -176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.230000000000004 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.73 HD21 HD11 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.019999999999996 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.586 ' N ' HD13 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 64.209999999999994 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 72.129999999999995 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 65.239999999999995 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 71.030000000000001 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.549999999999997 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.519999999999996 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.349999999999994 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.030000000000001 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 73.099999999999994 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.439999999999998 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.409 ' HG3' ' HH ' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 73.129999999999995 110.188 177.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 72.430000000000007 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.030000000000001 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HB2' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.409999999999997 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.219999999999999 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 74.099999999999994 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.492 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.120000000000005 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.109999999999999 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.420000000000002 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.492 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.219999999999999 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . 0.529 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.120000000000005 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 75.439999999999998 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.529 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.040000000000006 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 72.120000000000005 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 70.409999999999997 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.478 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.230000000000004 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.150000000000006 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.319999999999993 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 72.109999999999999 109.38 175.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.150000000000006 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.439999999999998 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.497 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 47.5 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.299999999999997 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . 0.635 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 73.409999999999997 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.340000000000003 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.848 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.319999999999993 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.420000000000002 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 72.200000000000003 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 73.209999999999994 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.516 HG13 HD13 ' A' ' 31' ' ' ILE . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 74.430000000000007 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.239999999999995 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.436 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 73.450000000000003 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.239999999999995 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 73.430000000000007 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.239999999999995 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 73.140000000000001 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.329999999999998 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 73.230000000000004 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.030000000000001 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.540000000000006 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 63.240000000000002 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 74.409999999999997 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 75.120000000000005 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 71.310000000000002 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 73.019999999999996 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.030000000000001 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 72.239999999999995 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 63.219999999999999 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.030000000000001 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 71.140000000000001 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.412 HD13 HG23 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.421 HG22 ' HB3' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 73.129999999999995 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 73.340000000000003 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.576 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 65.340000000000003 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.584 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 75.319999999999993 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.708 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.319999999999993 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.420000000000002 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.430000000000007 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.476 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.310000000000002 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.5 HG23 HG11 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.239999999999995 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 72.040000000000006 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.584 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 74.200000000000003 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 72.019999999999996 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.412 HG23 HD13 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 73.109999999999999 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 63.310000000000002 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 75.310000000000002 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.140000000000001 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.120000000000005 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.536 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.230000000000004 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 75.540000000000006 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.420000000000002 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.430000000000007 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 73.510000000000005 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.230000000000004 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.530000000000001 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.010000000000005 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 74.030000000000001 110.388 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 75.310000000000002 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.539 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.129999999999995 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.453 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.349999999999994 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.751 ' HE2' HG22 ' A' ' 61' ' ' VAL . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.010000000000005 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.5 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 74.129999999999995 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 75.329999999999998 111.661 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.751 HG22 ' HE2' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 74.209999999999994 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.409999999999997 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 60.100000000000001 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 74.150000000000006 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.72 ' HZ2' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.329999999999998 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 75.219999999999999 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.109999999999999 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.340000000000003 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.129999999999995 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.140000000000001 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 64.150000000000006 110.499 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 63.310000000000002 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.150000000000006 109.608 176.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.219999999999999 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 70.150000000000006 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG23 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 74.049999999999997 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.66 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 72.040000000000006 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.407 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 71.129999999999995 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 71.400000000000006 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 72.099999999999994 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.030000000000001 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 71.540000000000006 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 71.209999999999994 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.519 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.210000000000001 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.66 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.430000000000007 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.340000000000003 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.439999999999998 110.416 177.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.400000000000006 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.619 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.450000000000003 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 75.420000000000002 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.219999999999999 110.534 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.299999999999997 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.430000000000007 109.416 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 63.530000000000001 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.896 HE22 HG22 ' A' ' 114' ' ' VAL . 84.4 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 74.420000000000002 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.319999999999993 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 71.420000000000002 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.219999999999999 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 74.120000000000005 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.310000000000002 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 111.303 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.150000000000006 111.754 176.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.299999999999997 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.589 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 73.209999999999994 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 71.120000000000005 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 70.409999999999997 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 70.010000000000005 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.329999999999998 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.049999999999997 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.848 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.340000000000003 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.513 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 64.409999999999997 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.896 HG22 HE22 ' A' ' 96' ' ' GLN . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.519999999999996 111.7 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 74.310000000000002 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 75.150000000000006 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 75.019999999999996 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.566 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 75.219999999999999 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 71.239999999999995 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . 0.436 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 75.239999999999995 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 73.120000000000005 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.509999999999998 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.784 ' HA ' HD21 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 71.120000000000005 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 72.310000000000002 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 61.109999999999999 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.509999999999998 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 73.200000000000003 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.099999999999994 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.537 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.409999999999997 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 71.040000000000006 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 73.150000000000006 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 73.409999999999997 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.020000000000003 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 70.019999999999996 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' SER . . . . . 0.441 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 62.520000000000003 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.140000000000001 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.465 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 65.329999999999998 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.219999999999999 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.535 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.120000000000005 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.430000000000007 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 71.040000000000006 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.310000000000002 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 75.400000000000006 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.210000000000001 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.310000000000002 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.529 HD12 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 65.439999999999998 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.52 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 72.409999999999997 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.140000000000001 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.140000000000001 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.239999999999995 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 75.349999999999994 111.535 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 73.510000000000005 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.951 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 74.329999999999998 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.239999999999995 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.049999999999997 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.219999999999999 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.479 HG11 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.030000000000001 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.209999999999994 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 71.530000000000001 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 73.109999999999999 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 64.319999999999993 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 72.340000000000003 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.519999999999996 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 71.140000000000001 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.403 HD21 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.209999999999994 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.520000000000003 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.666 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.439999999999998 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.120000000000005 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.675 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 74.540000000000006 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.209999999999994 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.230000000000004 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 73.310000000000002 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 74.430000000000007 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.408 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 71.0 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.430000000000007 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.049999999999997 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.485 ' HB3' ' HB1' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.120000000000005 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.428 ' HE1' ' HB3' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.299999999999997 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 75.549999999999997 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.140000000000001 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.472 ' HE1' HD21 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.310000000000002 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.310000000000002 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.549999999999997 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.517 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.340000000000003 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.319999999999993 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.049999999999997 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.140000000000001 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' ILE . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.100000000000001 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.430000000000007 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.517 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.349999999999994 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.469 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.129999999999995 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.430000000000007 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 74.430000000000007 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.310000000000002 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 71.409999999999997 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 72.540000000000006 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 73.109999999999999 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 73.450000000000003 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 72.200000000000003 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.439999999999998 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.613 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.099999999999994 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.409999999999997 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.310000000000002 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 74.510000000000005 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 75.030000000000001 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.409999999999997 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.681 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 75.129999999999995 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.571 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 62.340000000000003 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 62.350000000000001 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.230000000000004 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 73.030000000000001 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 74.420000000000002 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 74.439999999999998 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.010000000000005 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 53.210000000000001 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 71.299999999999997 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.510000000000005 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.408 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 54.310000000000002 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.548 ' HD3' ' N ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.310000000000002 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.299999999999997 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.540000000000006 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.530000000000001 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.340000000000003 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.455 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 62.299999999999997 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.310000000000002 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.409999999999997 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.239999999999995 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.659 HG13 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 71.219999999999999 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.659 ' H ' HG13 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.450000000000003 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.761 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.329999999999998 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.030000000000001 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.319999999999993 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.019999999999996 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.439999999999998 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.109999999999999 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.219999999999999 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 70.200000000000003 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.426 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.349999999999994 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.230000000000004 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.409999999999997 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.030000000000001 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 74.349999999999994 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 74.010000000000005 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 70.420000000000002 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.230000000000004 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.516 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.120000000000005 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.200000000000003 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.516 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 74.420000000000002 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.109999999999999 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 75.109999999999999 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 73.049999999999997 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 75.030000000000001 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.349999999999994 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.140000000000001 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.299999999999997 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 75.420000000000002 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 74.310000000000002 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 62.340000000000003 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.140000000000001 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 72.109999999999999 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.951 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.120000000000005 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 51.109999999999999 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 70.010000000000005 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.530000000000001 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.209999999999994 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 74.25 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.802 ' HA ' HD11 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 74.239999999999995 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.540000000000006 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.340000000000003 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.439999999999998 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.340000000000003 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.802 HD11 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 61.130000000000003 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.239999999999995 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.510000000000005 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.496 ' HG ' HG11 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 74.099999999999994 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 73.340000000000003 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.540000000000006 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 73.310000000000002 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.099999999999994 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 73.409999999999997 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.109999999999999 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 74.519999999999996 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.340000000000003 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 74.010000000000005 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.44 ' HA ' ' HZ2' ' A' ' 140' ' ' LYS . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.430000000000007 110.82 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.430000000000007 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.349999999999994 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.209999999999994 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.44 ' HZ2' ' HA ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.400000000000006 111.616 179.372 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.400000000000006 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.651 HG11 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.109999999999999 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 74.319999999999993 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.540000000000006 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.430000000000007 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.651 HD23 HG11 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.239999999999995 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.437 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 70.25 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' SER . . . . . 0.761 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.230000000000004 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.439999999999998 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.731 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.450000000000003 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 74.25 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 71.140000000000001 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 74.409999999999997 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.239999999999995 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.417 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 62.399999999999999 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 51.549999999999997 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 74.420000000000002 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.340000000000003 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 74.519999999999996 109.46 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.109999999999999 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.009999999999998 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.040000000000006 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.522 ' HA ' HG21 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.439999999999998 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 73.299999999999997 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.319999999999993 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 52.539999999999999 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.743 ' HH ' HD22 ' A' ' 123' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 74.040000000000006 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 74.450000000000003 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.120000000000005 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.349999999999994 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.468 ' HD2' HG23 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.400000000000006 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.400000000000006 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 75.420000000000002 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.437 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.230000000000004 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.524 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 73.040000000000006 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 75.540000000000006 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.401 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.140000000000001 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.340000000000003 110.762 -177.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.120000000000005 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.530000000000001 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.685 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 74.400000000000006 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.721 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.340000000000003 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 73.109999999999999 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 73.230000000000004 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.439999999999998 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.636 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.150000000000006 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.200000000000003 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 73.299999999999997 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 73.209999999999994 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 40' ' ' VAL . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 73.040000000000006 110.644 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.439999999999998 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.685 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.150000000000006 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 74.450000000000003 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 74.239999999999995 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.109999999999999 111.807 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.427 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 75.329999999999998 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.340000000000003 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.424 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.450000000000003 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 75.120000000000005 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 74.400000000000006 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.572 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 75.0 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 75.5 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.230000000000004 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.572 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 75.349999999999994 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 70.329999999999998 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.420000000000002 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.99 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 63.240000000000002 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.517 ' O ' HG21 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.049999999999997 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 75.310000000000002 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.99 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.140000000000001 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.239999999999995 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.869 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 65.200000000000003 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 74.329999999999998 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 75.239999999999995 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.319999999999993 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.522 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 73.530000000000001 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 75.420000000000002 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.869 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.510000000000005 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.625 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.540000000000006 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 64.409999999999997 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB1' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 62.520000000000003 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 72.510000000000005 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.586 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 74.040000000000006 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.329999999999998 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 64.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.444 HG12 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 72.200000000000003 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.140000000000001 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.519999999999996 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.475 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 72.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.030000000000001 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.109999999999999 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.540000000000006 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 85' ' ' GLY . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 74.409999999999997 109.121 173.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.140000000000001 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.4 ' H ' ' C ' ' A' ' 83' ' ' ALA . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.140000000000001 110.804 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 75.439999999999998 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 71.219999999999999 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.499 HG21 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.129999999999995 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 73.219999999999999 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.738 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 74.140000000000001 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.592 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.439999999999998 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.586 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.594 ' HB ' HD12 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.530000000000001 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.625 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.549999999999997 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 72.129999999999995 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 75.349999999999994 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.583 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 63.439999999999998 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.310000000000002 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 75.430000000000007 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.530000000000001 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.510000000000005 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.019999999999996 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.010000000000005 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.510000000000005 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.749 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.219999999999999 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 74.319999999999993 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.239999999999995 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.230000000000004 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.721 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.109999999999999 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 74.540000000000006 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 64.450000000000003 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 73.450000000000003 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.416 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.120000000000005 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 74.519999999999996 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.552 HH11 ' HB1' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.140000000000001 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.552 ' HB1' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 74.420000000000002 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.566 HD11 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 75.230000000000004 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.72 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.030000000000001 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.340000000000003 112.229 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 61.229999999999997 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.420000000000002 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.743 HD22 ' HH ' ' A' ' 15' ' ' TYR . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 73.120000000000005 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.209999999999994 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 73.129999999999995 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.734 HD22 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 64.430000000000007 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 71.400000000000006 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . 0.446 HE21 ' HB3' ' A' ' 128' ' ' GLN . 0.9 OUTLIER -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 74.129999999999995 110.444 176.876 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 74.310000000000002 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.310000000000002 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 64.340000000000003 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 73.030000000000001 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.403 ' HB2' ' H ' ' A' ' 134' ' ' MET . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 75.120000000000005 112.048 -175.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.553 ' HB3' HG13 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 72.430000000000007 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.130000000000003 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.040000000000006 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . 0.454 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 74.340000000000003 112.241 -176.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 71.049999999999997 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' SER . . . . . 0.581 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 72.219999999999999 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 72.150000000000006 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.475 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.420000000000002 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.329999999999998 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 75.200000000000003 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.491 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.310000000000002 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 74.219999999999999 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 73.299999999999997 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.734 ' HA ' HD22 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 74.540000000000006 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 75.510000000000005 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ILE . . . . . 0.446 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.621 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.420000000000002 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.200000000000003 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.140000000000001 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.209999999999994 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 74.549999999999997 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.310000000000002 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.209999999999994 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.481 ' HB3' ' HG ' ' A' ' 11' ' ' CYS . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.450000000000003 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.450000000000003 113.069 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 64.140000000000001 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.746 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.230000000000004 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.230000000000004 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.450000000000003 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.230000000000004 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.340000000000003 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 73.310000000000002 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.420000000000002 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.509 HD13 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.120000000000005 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.509 ' N ' HD13 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 71.329999999999998 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.209999999999994 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 74.049999999999997 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.299999999999997 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.530000000000001 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.451 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.430000000000007 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.5 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 71.310000000000002 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.768 HD12 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 73.430000000000007 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.549999999999997 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.746 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.616 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.4 ' N ' HD13 ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.109999999999999 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 64.430000000000007 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.310000000000002 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.010000000000005 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.451 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.219999999999999 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.399999999999999 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.299999999999997 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 74.140000000000001 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.483 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.239999999999995 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 HD12 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 72.400000000000006 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.616 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 61.43 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB3' HD13 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 75.109999999999999 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 74.409999999999997 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.454 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 73.400000000000006 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.409999999999997 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.219999999999999 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 71.310000000000002 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 71.450000000000003 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 71.200000000000003 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.540000000000006 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.319999999999993 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 74.319999999999993 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 74.340000000000003 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.239999999999995 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 74.040000000000006 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.129999999999995 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.109999999999999 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.099999999999994 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 72.540000000000006 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.040000000000006 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 72.540000000000006 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.209999999999994 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 52.020000000000003 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.230000000000004 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.601 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 73.510000000000005 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.658 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 72.019999999999996 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.601 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.120000000000005 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.743 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.510000000000005 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 45.43 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 62.299999999999997 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.530000000000001 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.340000000000003 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 73.109999999999999 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 72.439999999999998 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.573 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.150000000000006 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 75.430000000000007 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.794 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 73.150000000000006 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.129999999999995 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.449 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 21.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 70.150000000000006 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 72.420000000000002 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.209999999999994 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 73.310000000000002 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.439999999999998 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.349999999999994 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.794 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.430000000000007 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.469 HG21 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.439999999999998 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 74.439999999999998 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.569 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.109999999999999 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.546 HG12 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.430000000000007 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.54 ' HB ' HD11 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.340000000000003 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 72.450000000000003 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 75.310000000000002 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 74.329999999999998 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 75.109999999999999 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 63.130000000000003 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.624 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 71.140000000000001 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 64.430000000000007 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.230000000000004 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 71.439999999999998 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.430000000000007 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 73.140000000000001 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.518 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.349999999999994 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.658 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.230000000000004 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 75.439999999999998 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.510000000000005 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 73.239999999999995 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 74.049999999999997 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.621 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.130000000000003 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.532 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.530000000000001 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.525 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 72.310000000000002 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 73.430000000000007 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.404 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.109999999999999 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.229999999999997 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.582 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 75.209999999999994 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.482 ' N ' HD13 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 75.230000000000004 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 75.439999999999998 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.420000000000002 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.582 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 74.430000000000007 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.439999999999998 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.701 ' HA ' HD22 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 75.299999999999997 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.120000000000005 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 65.140000000000001 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.701 HD22 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.299999999999997 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.430000000000007 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 64.549999999999997 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.549999999999997 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.030000000000001 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 63.140000000000001 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.624 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.040000000000006 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.140000000000001 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.109999999999999 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 55.240000000000002 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.299999999999997 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.150000000000006 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.219999999999999 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 75.5 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 72.019999999999996 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.299999999999997 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.209999999999994 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 71.430000000000007 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.430000000000007 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.299999999999997 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.522 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.340000000000003 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 74.200000000000003 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . 0.491 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 72.310000000000002 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.573 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 70.219999999999999 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 75.439999999999998 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . 0.491 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.802 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.439999999999998 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 60.25 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.099999999999994 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 65.140000000000001 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.540000000000006 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.239999999999995 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.457 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.420000000000002 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.519999999999996 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.109999999999999 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.450000000000003 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.400000000000006 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 73.25 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.230000000000004 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.596 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 75.120000000000005 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.799 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.430000000000007 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.520000000000003 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 72.140000000000001 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.799 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 62.32 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.420000000000002 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.534 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 74.430000000000007 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.400000000000006 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.439999999999998 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.636 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.510000000000005 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.715 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.530000000000001 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.673 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.209999999999994 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 75.319999999999993 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.608 HG21 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 75.219999999999999 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.714 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.349999999999994 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.943 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 75.439999999999998 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.439 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.329999999999998 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.943 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.439999999999998 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.95 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 73.310000000000002 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.519999999999996 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.95 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.450000000000003 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.497 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 73.409999999999997 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.585 ' HB1' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.430000000000007 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.458 HD11 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.549999999999997 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 73.349999999999994 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 75.239999999999995 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.845 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.319999999999993 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 73.400000000000006 110.743 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.450000000000003 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.657 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.239999999999995 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.040000000000006 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.715 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 72.140000000000001 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.340000000000003 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB1' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.530000000000001 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.299999999999997 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.573 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 73.519999999999996 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.209999999999994 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 73.329999999999998 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.657 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 74.209999999999994 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.340000000000003 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.109999999999999 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.66 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.420000000000002 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.409999999999997 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.415 ' C ' ' HD2' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 75.299999999999997 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.140000000000001 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 70.030000000000001 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 74.510000000000005 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.528 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.109999999999999 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.209999999999994 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 71.129999999999995 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.519999999999996 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.439999999999998 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.555 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 70.329999999999998 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HB3' HG21 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.430000000000007 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.714 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.319999999999993 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.530000000000001 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 64.230000000000004 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.673 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 74.530000000000001 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.675 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.439999999999998 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.329999999999998 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.4 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.310000000000002 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.439999999999998 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 75.430000000000007 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 73.319999999999993 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.230000000000004 110.136 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 73.150000000000006 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 74.340000000000003 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.540000000000006 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 74.310000000000002 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.510000000000005 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.329999999999998 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.349999999999994 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.400000000000006 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 73.239999999999995 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.51 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.019999999999996 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.4 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.209999999999994 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.019999999999996 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.675 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 75.519999999999996 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.502 HD11 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 73.040000000000006 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.505 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.349999999999994 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.230000000000004 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.549999999999997 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 71.450000000000003 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.587 ' HG2' ' HB1' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 75.409999999999997 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.109999999999999 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.587 ' HB1' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.049999999999997 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.467 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 75.120000000000005 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.239999999999995 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.555 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.219999999999999 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.467 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.430000000000007 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.420000000000002 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 74.349999999999994 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.319999999999993 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.428 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 74.010000000000005 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.329999999999998 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.524 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 72.409999999999997 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.519999999999996 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.802 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.439999999999998 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.430000000000007 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.47 HD13 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.549999999999997 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 75.209999999999994 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 54.009999999999998 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.200000000000003 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 74.150000000000006 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 71.239999999999995 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.64 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.409999999999997 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.509 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 74.349999999999994 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.509 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.439999999999998 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 72.299999999999997 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 74.150000000000006 110.619 -174.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.505 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.319999999999993 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 60.229999999999997 110.514 -175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 75.409999999999997 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.457 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 55.200000000000003 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.430000000000007 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.010000000000005 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 71.219999999999999 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.299999999999997 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 71.239999999999995 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 72.209999999999994 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.540000000000006 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.349999999999994 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.329999999999998 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.644 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 44.340000000000003 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 74.439999999999998 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.239999999999995 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 75.030000000000001 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.040000000000006 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.53 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 72.519999999999996 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.446 ' N ' HD13 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 71.129999999999995 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 73.120000000000005 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 71.25 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 75.109999999999999 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.040000000000006 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 74.040000000000006 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.664 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.540000000000006 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 61.32 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.310000000000002 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.349999999999994 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.667 HG23 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.549999999999997 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 74.409999999999997 111.388 -176.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.120000000000005 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 54.539999999999999 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 74.340000000000003 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.340000000000003 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.109999999999999 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HZ2' ' CG ' ' A' ' 16' ' ' ASP . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 73.150000000000006 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.418 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 73.310000000000002 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.578 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 74.099999999999994 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.446 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.340000000000003 110.849 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 75.019999999999996 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.789 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.530000000000001 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 72.319999999999993 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.310000000000002 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.439999999999998 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.129999999999995 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 75.129999999999995 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.310000000000002 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.039999999999999 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.415 ' HB3' HG22 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.040000000000006 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.406 HD13 HG23 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.049999999999997 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.329999999999998 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.747 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 74.230000000000004 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.895 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 75.310000000000002 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 73.0 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.781 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 73.310000000000002 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.848 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.099999999999994 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.409999999999997 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.430000000000007 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.848 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 62.009999999999998 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.72 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 64.409999999999997 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 73.209999999999994 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.407 HG12 HG11 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 71.310000000000002 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.667 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 64.439999999999998 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 74.140000000000001 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.407 HG11 HG12 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 73.140000000000001 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.299999999999997 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.430000000000007 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 1.053 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.209999999999994 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 63.439999999999998 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 73.319999999999993 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.420000000000002 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.530000000000001 110.478 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 51.539999999999999 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.514 ' HZ ' ' HB2' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 74.340000000000003 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 73.219999999999999 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 71.25 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.239999999999995 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.519999999999996 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.409999999999997 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.049999999999997 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.219999999999999 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.419 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.329999999999998 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 64.400000000000006 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.310000000000002 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.120000000000005 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 74.329999999999998 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.467 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.049999999999997 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 72.230000000000004 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.895 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 74.510000000000005 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.747 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.099999999999994 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HB2' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 70.319999999999993 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.340000000000003 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 73.200000000000003 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 73.120000000000005 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 73.219999999999999 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.834 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.019999999999996 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 75.109999999999999 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.129999999999995 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 75.099999999999994 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.656 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.430000000000007 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.656 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.439999999999998 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 74.329999999999998 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.400000000000006 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 53.450000000000003 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.140000000000001 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 72.109999999999999 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 75.310000000000002 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.519999999999996 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 72.200000000000003 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.47 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.834 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.340000000000003 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 72.409999999999997 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.561 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.439999999999998 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.530000000000001 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.638 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 74.239999999999995 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 74.299999999999997 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.109999999999999 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 74.510000000000005 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.099999999999994 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.239999999999995 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 74.5 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.641 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.430000000000007 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.209999999999994 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.319999999999993 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.641 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 73.319999999999993 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.510000000000005 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 71.310000000000002 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.423 ' O ' HG22 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 62.030000000000001 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 71.010000000000005 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.664 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.299999999999997 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG23 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 74.420000000000002 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.25 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.443 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 75.430000000000007 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.209999999999994 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 73.420000000000002 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 75.010000000000005 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 64.150000000000006 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 74.239999999999995 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.420000000000002 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.510000000000005 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.030000000000001 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.239999999999995 112.37 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.340000000000003 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 71.310000000000002 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 75.329999999999998 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.638 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 74.340000000000003 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 74.129999999999995 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.310000000000002 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.42 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 64.230000000000004 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.209999999999994 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.658 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.439999999999998 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 74.430000000000007 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.534 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.109999999999999 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.658 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 63.119999999999997 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.771 ' H ' HD11 ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.329999999999998 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 70.310000000000002 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.109999999999999 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 75.450000000000003 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 72.040000000000006 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 75.540000000000006 112.302 -171.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.400000000000006 111.208 -175.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.310000000000002 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.420000000000002 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.319999999999993 110.682 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 74.5 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.230000000000004 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . 0.516 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.219999999999999 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 75.319999999999993 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.430000000000007 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . 0.554 HD12 ' OXT' ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 75.420000000000002 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.617 ' HG2' ' HB2' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 73.209999999999994 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.319999999999993 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 63.130000000000003 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.140000000000001 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 75.209999999999994 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.507 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.019999999999996 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 72.329999999999998 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 74.409999999999997 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.405 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.349999999999994 110.047 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.439999999999998 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.441 ' C ' HD21 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 73.219999999999999 109.618 175.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.329999999999998 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.443 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 74.510000000000005 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.120000000000005 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.120000000000005 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 73.409999999999997 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 74.409999999999997 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 74.329999999999998 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.784 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 74.219999999999999 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.019999999999996 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.319999999999993 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 75.5 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.678 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.340000000000003 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 73.299999999999997 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 72.109999999999999 109.236 171.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.439999999999998 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.625 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.230000000000004 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 71.400000000000006 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.129999999999995 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.340000000000003 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 74.25 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.491 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 72.430000000000007 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.519999999999996 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.120000000000005 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.419 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 75.140000000000001 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.240000000000002 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.140000000000001 110.501 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.299999999999997 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 73.040000000000006 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.400000000000006 109.384 177.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.340000000000003 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.678 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 74.530000000000001 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 75.030000000000001 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 73.129999999999995 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 74.310000000000002 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.529 ' O ' HG22 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 71.340000000000003 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.329999999999998 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.140000000000001 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.687 ' HZ ' ' HB3' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 65.310000000000002 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.219999999999999 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 73.129999999999995 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.84 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 74.409999999999997 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.47 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 73.439999999999998 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.239999999999995 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.84 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 73.239999999999995 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.563 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 74.540000000000006 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.489 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 64.209999999999994 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.409999999999997 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 61.450000000000003 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 71.129999999999995 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 74.140000000000001 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.489 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.150000000000006 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 72.25 108.414 171.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.563 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 75.219999999999999 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.625 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.687 ' HB3' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 63.020000000000003 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.319999999999993 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.555 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.439999999999998 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.239999999999995 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.798 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 72.109999999999999 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.310000000000002 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.349999999999994 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.319999999999993 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 60.310000000000002 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 75.340000000000003 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 75.140000000000001 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.450000000000003 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.746 ' HB2' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.010000000000005 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 72.430000000000007 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.340000000000003 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.519999999999996 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.746 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 74.239999999999995 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.61 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 72.019999999999996 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.403 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 74.230000000000004 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.798 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.420000000000002 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 73.409999999999997 110.483 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 73.010000000000005 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 73.409999999999997 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.604 ' HE2' HD13 ' A' ' 117' ' ' LEU . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 75.099999999999994 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.200000000000003 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.120000000000005 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 71.510000000000005 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.200000000000003 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 64.099999999999994 112.125 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.450000000000003 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.209999999999994 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.608 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.310000000000002 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.568 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.510000000000005 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.43 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.239999999999995 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 75.219999999999999 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.329999999999998 111.077 -176.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.669 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.340000000000003 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.540000000000006 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.209999999999994 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.669 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.439999999999998 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.617 ' HB2' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 71.219999999999999 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 73.510000000000005 111.361 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.597 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.099999999999994 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.109999999999999 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 73.219999999999999 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.530000000000001 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.604 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.409999999999997 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.536 ' N ' HD11 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.200000000000003 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 72.439999999999998 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.507 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.109999999999999 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.129999999999995 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 71.439999999999998 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 53.130000000000003 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 74.400000000000006 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 75.299999999999997 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.349999999999994 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.593 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 74.120000000000005 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 65.400000000000006 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.450000000000003 111.36 -177.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.109999999999999 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 64.409999999999997 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.400000000000006 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.530000000000001 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 74.420000000000002 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.409999999999997 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.109999999999999 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 74.510000000000005 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 74.010000000000005 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.140000000000001 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 75.239999999999995 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.540000000000006 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.140000000000001 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.400000000000006 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 75.230000000000004 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 70.319999999999993 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.415 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.400000000000006 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.430000000000007 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . 0.4 HD13 ' OXT' ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 62.119999999999997 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.409999999999997 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.530000000000001 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 55.200000000000003 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.150000000000006 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.120000000000005 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.319999999999993 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 62.340000000000003 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.319999999999993 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.425 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 73.25 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 73.340000000000003 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 74.510000000000005 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.605 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 63.350000000000001 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 73.049999999999997 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.120000000000005 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.713 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 61.100000000000001 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 75.430000000000007 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.713 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.400000000000006 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.239999999999995 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.400000000000006 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.530000000000001 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.310000000000002 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.519999999999996 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 73.010000000000005 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 75.219999999999999 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.49 HD12 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.420000000000002 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.507 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.329999999999998 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.549 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.230000000000004 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.517 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 64.540000000000006 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 72.310000000000002 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.69 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.030000000000001 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.409999999999997 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.439999999999998 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.329999999999998 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.420000000000002 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 72.150000000000006 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.507 HD12 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.230000000000004 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.626 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 74.510000000000005 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.49 HG13 HD12 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.099999999999994 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.517 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 73.209999999999994 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 73.439999999999998 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.420000000000002 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 74.540000000000006 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.040000000000006 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 64.349999999999994 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.519999999999996 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.43 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.420000000000002 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 70.319999999999993 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.468 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 71.019999999999996 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 73.030000000000001 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.120000000000005 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 71.519999999999996 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 71.420000000000002 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.430000000000007 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.030000000000001 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.4 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 75.439999999999998 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 73.439999999999998 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.56 ' HZ1' ' HB2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 73.349999999999994 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.44 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 75.120000000000005 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 72.120000000000005 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.472 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.430000000000007 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.439999999999998 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.430000000000007 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.319999999999993 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.443 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 73.129999999999995 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.530000000000001 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.619 ' HE ' ' HA ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.5 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.239999999999995 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 74.209999999999994 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.129999999999995 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.707 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.209999999999994 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.209999999999994 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 72.109999999999999 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.534 HG13 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.400000000000006 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 73.099999999999994 110.67 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.555 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 73.420000000000002 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 75.519999999999996 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 74.540000000000006 110.517 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 70.129999999999995 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.329999999999998 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.420000000000002 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 61.539999999999999 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 73.409999999999997 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.530000000000001 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.555 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 75.25 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.58 HG23 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 75.239999999999995 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.528 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.120000000000005 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.404 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.510000000000005 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.707 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.519999999999996 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.671 HD13 HG22 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 70.049999999999997 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.674 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 74.219999999999999 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 74.510000000000005 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 72.340000000000003 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.120000000000005 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.299999999999997 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.019999999999996 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.48 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.049999999999997 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.472 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 73.329999999999998 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.340000000000003 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.439999999999998 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 75.150000000000006 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.430000000000007 110.399 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 70.409999999999997 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 72.439999999999998 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.329999999999998 110.688 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.120000000000005 110.954 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.519999999999996 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.493 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.439999999999998 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 75.530000000000001 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.402 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.519999999999996 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.120000000000005 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB3' HD12 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.120000000000005 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.499 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.430000000000007 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 73.120000000000005 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 71.409999999999997 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.492 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 75.450000000000003 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.229999999999997 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.742 ' HA ' HD21 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.450000000000003 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.510000000000005 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 72.420000000000002 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 72.299999999999997 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.48 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.540000000000006 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.510000000000005 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.671 HG22 HD13 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.439999999999998 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.468 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 74.540000000000006 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.442 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 75.129999999999995 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.406 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.219999999999999 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 72.319999999999993 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.415 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.140000000000001 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.442 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.319999999999993 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.310000000000002 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.219999999999999 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 75.540000000000006 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.519999999999996 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.455 HG22 HG12 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 74.450000000000003 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.310000000000002 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.508 ' HA ' ' HE3' ' A' ' 147' ' ' MET . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.129999999999995 111.479 -178.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.129999999999995 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.534 ' HG3' HG13 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.239999999999995 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.530000000000001 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 74.140000000000001 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.528 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.129999999999995 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 72.310000000000002 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.675 ' HG2' ' HB2' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 74.239999999999995 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 73.349999999999994 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.449 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 73.319999999999993 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 55.140000000000001 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.763 HG12 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.549999999999997 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 64.0 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.574 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.019999999999996 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.140000000000001 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 72.209999999999994 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.099999999999994 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.130000000000003 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.25 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 72.109999999999999 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 64.450000000000003 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.445 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.219999999999999 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.530000000000001 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.099999999999994 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.654 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.400000000000006 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.310000000000002 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.150000000000006 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.349999999999994 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.654 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.420000000000002 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.448 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.340000000000003 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.456 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 72.219999999999999 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 71.319999999999993 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.467 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.140000000000001 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.049999999999997 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.472 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 74.329999999999998 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.040000000000006 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.439999999999998 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.525 HD11 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.019999999999996 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.519999999999996 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.74 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 74.400000000000006 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 74.219999999999999 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.74 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 75.200000000000003 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.763 ' HB ' HG12 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.019999999999996 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.519999999999996 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.581 HD11 HD21 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.140000000000001 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 71.150000000000006 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.030000000000001 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.420000000000002 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 75.540000000000006 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.46 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.299999999999997 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.420000000000002 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.576 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 71.150000000000006 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 71.109999999999999 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 64.329999999999998 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.209999999999994 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' HG22 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 70.409999999999997 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 75.209999999999994 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 62.130000000000003 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 74.099999999999994 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.319999999999993 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.230000000000004 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.310000000000002 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.411 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.319999999999993 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.510000000000005 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.41 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 74.310000000000002 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.230000000000004 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 65.129999999999995 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.129999999999995 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.349999999999994 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.399999999999999 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.400000000000006 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 72.25 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.020000000000003 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.472 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 71.540000000000006 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.509999999999998 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.425 ' HB2' ' HZ ' ' A' ' 53' ' ' PHE . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.040000000000006 112.083 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 53.439999999999998 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.455 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.519999999999996 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.439 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.549999999999997 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 65.140000000000001 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.793 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 71.140000000000001 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 74.409999999999997 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 74.120000000000005 111.328 -175.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 79' ' ' GLN . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 74.349999999999994 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.417 ' H ' HG12 ' A' ' 78' ' ' VAL . 33.3 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 72.209999999999994 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.530000000000001 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.519999999999996 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 74.340000000000003 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.140000000000001 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.010000000000005 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.209999999999994 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.450000000000003 109.748 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 74.340000000000003 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 75.209999999999994 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.793 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.420000000000002 110.284 176.354 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.57 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 75.540000000000006 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.340000000000003 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 72.310000000000002 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.629 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 72.329999999999998 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 72.239999999999995 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.49 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 75.010000000000005 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.469 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 74.329999999999998 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.439999999999998 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.109999999999999 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.120000000000005 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.129999999999995 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.209999999999994 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.540000000000006 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.439999999999998 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.409999999999997 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 74.549999999999997 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.299999999999997 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 70.120000000000005 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.525 ' HB3' HD11 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.439999999999998 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.430000000000007 110.559 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.675 ' HB2' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.430000000000007 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.409999999999997 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.340000000000003 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.540000000000006 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.230000000000004 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.420000000000002 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.120000000000005 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.019999999999996 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.299999999999997 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 74.019999999999996 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.584 HD21 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.049999999999997 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 74.310000000000002 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.120000000000005 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.340000000000003 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 75.129999999999995 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.319999999999993 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.510000000000005 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.629 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.439999999999998 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.329999999999998 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.49 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.200000000000003 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 70.040000000000006 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.519999999999996 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.409999999999997 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.532 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 64.129999999999995 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 74.0 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 74.239999999999995 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 71.200000000000003 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 73.120000000000005 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.501 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.349999999999994 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 74.420000000000002 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 50.32 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 74.319999999999993 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 75.349999999999994 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.140000000000001 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.239999999999995 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.452 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 75.140000000000001 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.310000000000002 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.340000000000003 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.57 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 73.409999999999997 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . 0.616 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 74.439999999999998 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 71.209999999999994 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.597 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.230000000000004 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.319999999999993 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 73.519999999999996 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 73.310000000000002 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.319999999999993 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.209999999999994 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 75.519999999999996 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 74.400000000000006 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 72.239999999999995 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.509999999999998 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.524 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.519999999999996 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.349999999999994 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 73.340000000000003 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.628 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 74.230000000000004 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 73.129999999999995 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.540000000000006 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 74.549999999999997 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.409999999999997 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 75.099999999999994 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 74.340000000000003 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 75.340000000000003 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 72.329999999999998 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.812 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.129999999999995 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.349999999999994 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.644 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.109999999999999 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.611 HD12 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 75.239999999999995 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.420000000000002 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.524 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.109999999999999 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.612 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 65.329999999999998 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 65.530000000000001 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.602 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.239999999999995 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 73.409999999999997 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.219999999999999 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.520000000000003 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.310000000000002 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.481 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 72.340000000000003 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.73 HD11 HD21 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.140000000000001 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.239999999999995 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.611 HG22 HD12 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.349999999999994 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 73.340000000000003 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.798 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 73.030000000000001 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.340000000000003 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 62.039999999999999 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.442 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 73.140000000000001 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.442 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.129999999999995 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.040000000000006 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HB1' ' HH ' ' A' ' 26' ' ' TYR . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 72.140000000000001 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.400000000000006 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HH ' HG23 ' A' ' 74' ' ' VAL . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 74.439999999999998 110.814 178.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 74.219999999999999 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.239999999999995 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 75.409999999999997 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.62 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.420000000000002 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.798 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.319999999999993 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.299999999999997 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.62 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.549999999999997 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.519999999999996 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 75.420000000000002 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.030000000000001 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.583 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.150000000000006 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.219999999999999 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 71.040000000000006 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 72.239999999999995 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.030000000000001 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.438 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 71.329999999999998 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.612 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 75.230000000000004 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HH ' ' HG3' ' A' ' 128' ' ' GLN . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.420000000000002 108.661 175.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 70.420000000000002 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 71.230000000000004 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.614 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.239999999999995 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.838 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.210000000000001 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.501 HG23 ' HH ' ' A' ' 50' ' ' TYR . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.129999999999995 109.706 177.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.614 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.430000000000007 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.42 ' HB ' HE22 ' A' ' 150' ' ' GLN . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.340000000000003 109.719 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 74.409999999999997 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 72.219999999999999 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.049999999999997 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 75.530000000000001 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.040000000000006 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.099999999999994 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 73.219999999999999 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.099999999999994 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.496 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.219999999999999 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.109999999999999 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.209999999999994 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 70.209999999999994 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.458 HD23 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.109999999999999 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.614 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.530000000000001 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.497 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 74.120000000000005 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.838 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.120000000000005 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 75.340000000000003 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.469 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.340000000000003 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 71.310000000000002 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.430000000000007 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.476 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.519999999999996 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 75.299999999999997 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 71.150000000000006 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.430000000000007 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.427 ' HB2' ' HG2' ' A' ' 107' ' ' ARG . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 74.209999999999994 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.672 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 71.239999999999995 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 65.099999999999994 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.319999999999993 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.319999999999993 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 75.099999999999994 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 74.109999999999999 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.150000000000006 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.329999999999998 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.530000000000001 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.597 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.239999999999995 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.129999999999995 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.510000000000005 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.530000000000001 111.05 -176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.230000000000004 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.73 HD21 HD11 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.019999999999996 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.586 ' N ' HD13 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 64.209999999999994 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 72.129999999999995 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 65.239999999999995 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 71.030000000000001 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.549999999999997 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.519999999999996 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.558 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.349999999999994 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.030000000000001 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 73.099999999999994 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.439999999999998 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.409 ' HG3' ' HH ' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 73.129999999999995 110.188 177.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 72.430000000000007 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.030000000000001 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.524 ' HB2' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.409999999999997 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.219999999999999 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 74.099999999999994 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.492 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.120000000000005 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.109999999999999 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.420000000000002 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.492 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.219999999999999 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.529 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.120000000000005 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 75.439999999999998 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.529 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.040000000000006 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 72.120000000000005 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 70.409999999999997 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.478 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.230000000000004 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 71.109999999999999 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.150000000000006 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.319999999999993 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 72.109999999999999 109.38 175.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.150000000000006 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.439999999999998 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.497 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 47.5 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.299999999999997 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . 0.635 ' HD3' ' O ' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 73.409999999999997 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.340000000000003 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.848 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.319999999999993 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.420000000000002 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 72.200000000000003 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 73.209999999999994 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.516 HG13 HD13 ' A' ' 31' ' ' ILE . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 74.430000000000007 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.239999999999995 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.436 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 73.450000000000003 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.239999999999995 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 73.430000000000007 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.239999999999995 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 73.140000000000001 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.329999999999998 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 73.230000000000004 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.030000000000001 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.540000000000006 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 63.240000000000002 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 74.409999999999997 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 75.120000000000005 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 71.310000000000002 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 73.019999999999996 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.030000000000001 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 72.239999999999995 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 63.219999999999999 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.030000000000001 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 71.140000000000001 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.412 HD13 HG23 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.421 HG22 ' HB3' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 73.129999999999995 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 73.340000000000003 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.576 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 65.340000000000003 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.584 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 75.319999999999993 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.708 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.319999999999993 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.420000000000002 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.430000000000007 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.476 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.310000000000002 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.5 HG23 HG11 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.239999999999995 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 72.040000000000006 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.584 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 74.200000000000003 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 72.019999999999996 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.412 HG23 HD13 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 73.109999999999999 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 63.310000000000002 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 75.310000000000002 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.140000000000001 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.120000000000005 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.536 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.230000000000004 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 75.540000000000006 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.420000000000002 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.430000000000007 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 73.510000000000005 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.230000000000004 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.530000000000001 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.010000000000005 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 74.030000000000001 110.388 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 75.310000000000002 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.539 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.129999999999995 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.453 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.349999999999994 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.751 ' HE2' HG22 ' A' ' 61' ' ' VAL . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.010000000000005 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.5 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 74.129999999999995 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 75.329999999999998 111.661 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.751 HG22 ' HE2' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 74.209999999999994 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.409999999999997 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 60.100000000000001 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 74.150000000000006 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.72 ' HZ2' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.329999999999998 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 75.219999999999999 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.109999999999999 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.340000000000003 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.129999999999995 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.140000000000001 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 64.150000000000006 110.499 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 63.310000000000002 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.150000000000006 109.608 176.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.219999999999999 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 70.150000000000006 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG23 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 74.049999999999997 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.66 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 72.040000000000006 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.407 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 71.129999999999995 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 71.400000000000006 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 72.099999999999994 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.030000000000001 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 71.540000000000006 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 71.209999999999994 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.519 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.210000000000001 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.66 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.430000000000007 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.340000000000003 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.439999999999998 110.416 177.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.400000000000006 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.619 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.450000000000003 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 75.420000000000002 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.219999999999999 110.534 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.529 ' HB ' HD12 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.299999999999997 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.430000000000007 109.416 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 63.530000000000001 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.896 HE22 HG22 ' A' ' 114' ' ' VAL . 84.4 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 74.420000000000002 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.319999999999993 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 71.420000000000002 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.219999999999999 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 74.120000000000005 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.310000000000002 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 111.303 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.150000000000006 111.754 176.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.299999999999997 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.589 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 73.209999999999994 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 71.120000000000005 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.554 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 70.409999999999997 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 70.010000000000005 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.329999999999998 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.049999999999997 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.848 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.340000000000003 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.513 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 64.409999999999997 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.896 HG22 HE22 ' A' ' 96' ' ' GLN . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.519999999999996 111.7 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 74.310000000000002 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 75.150000000000006 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 75.019999999999996 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.566 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 75.219999999999999 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 71.239999999999995 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.436 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 75.239999999999995 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 73.120000000000005 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.509999999999998 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.784 ' HA ' HD21 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 71.120000000000005 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 72.310000000000002 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 61.109999999999999 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.784 HD21 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.509999999999998 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 73.200000000000003 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.099999999999994 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.537 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.409999999999997 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 71.040000000000006 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 73.150000000000006 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 73.409999999999997 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.020000000000003 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 70.019999999999996 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.441 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 62.520000000000003 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.140000000000001 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.465 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 65.329999999999998 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.219999999999999 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.535 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.120000000000005 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.430000000000007 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 71.040000000000006 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.310000000000002 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 75.400000000000006 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.210000000000001 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.310000000000002 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.529 HD12 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 65.439999999999998 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.52 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 72.409999999999997 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.140000000000001 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.140000000000001 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.239999999999995 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 75.349999999999994 111.535 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 73.510000000000005 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.951 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 74.329999999999998 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.239999999999995 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.049999999999997 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.219999999999999 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.479 HG11 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.030000000000001 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.209999999999994 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 71.530000000000001 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 73.109999999999999 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 64.319999999999993 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 72.340000000000003 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.519999999999996 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 71.140000000000001 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.403 HD21 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.209999999999994 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.520000000000003 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.666 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.439999999999998 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.120000000000005 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.675 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 74.540000000000006 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.209999999999994 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.230000000000004 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 73.310000000000002 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 74.430000000000007 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.408 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 71.0 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.430000000000007 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.049999999999997 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.485 ' HB3' ' HB1' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.120000000000005 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.428 ' HE1' ' HB3' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.299999999999997 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 75.549999999999997 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.140000000000001 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.472 ' HE1' HD21 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.310000000000002 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.310000000000002 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.549999999999997 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.517 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.340000000000003 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.319999999999993 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.049999999999997 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.140000000000001 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' ILE . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.100000000000001 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.430000000000007 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.517 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.349999999999994 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.469 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.129999999999995 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.430000000000007 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 74.430000000000007 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.310000000000002 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 71.409999999999997 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 72.540000000000006 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 73.109999999999999 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 73.450000000000003 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 72.200000000000003 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.439999999999998 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.613 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.099999999999994 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.409999999999997 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.310000000000002 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 74.510000000000005 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 75.030000000000001 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.409999999999997 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.681 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 75.129999999999995 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.571 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 62.340000000000003 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 62.350000000000001 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.230000000000004 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 73.030000000000001 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 74.420000000000002 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 74.439999999999998 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.010000000000005 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 53.210000000000001 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 71.299999999999997 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.510000000000005 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.408 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 54.310000000000002 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.548 ' HD3' ' N ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.310000000000002 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.299999999999997 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.540000000000006 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.530000000000001 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.340000000000003 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.455 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 62.299999999999997 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.310000000000002 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.409999999999997 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.239999999999995 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.659 HG13 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 71.219999999999999 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.659 ' H ' HG13 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.450000000000003 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.761 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.329999999999998 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.030000000000001 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.319999999999993 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.019999999999996 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.439999999999998 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.109999999999999 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.219999999999999 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 70.200000000000003 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.426 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.349999999999994 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.230000000000004 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.731 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.409999999999997 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.030000000000001 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 74.349999999999994 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 74.010000000000005 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 70.420000000000002 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.230000000000004 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.516 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.120000000000005 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.200000000000003 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.516 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 74.420000000000002 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.109999999999999 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 75.109999999999999 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 73.049999999999997 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 75.030000000000001 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.349999999999994 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.140000000000001 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.299999999999997 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 75.420000000000002 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 74.310000000000002 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 62.340000000000003 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.140000000000001 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 72.109999999999999 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.951 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.120000000000005 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 51.109999999999999 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 70.010000000000005 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.530000000000001 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.209999999999994 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 74.25 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.802 ' HA ' HD11 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 74.239999999999995 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.540000000000006 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.340000000000003 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.439999999999998 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.340000000000003 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.802 HD11 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 61.130000000000003 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.239999999999995 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.510000000000005 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.496 ' HG ' HG11 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 74.099999999999994 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 73.340000000000003 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.540000000000006 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 73.310000000000002 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.099999999999994 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 73.409999999999997 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.109999999999999 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 74.519999999999996 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.340000000000003 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 74.010000000000005 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.44 ' HA ' ' HZ2' ' A' ' 140' ' ' LYS . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.430000000000007 110.82 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.430000000000007 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.349999999999994 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.209999999999994 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.44 ' HZ2' ' HA ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.400000000000006 111.616 179.372 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.400000000000006 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.651 HG11 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.109999999999999 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 74.319999999999993 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.540000000000006 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.430000000000007 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.651 HD23 HG11 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.239999999999995 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.437 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 70.25 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' SER . . . . . 0.761 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.230000000000004 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.439999999999998 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.731 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.450000000000003 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 74.25 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 71.140000000000001 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 74.409999999999997 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.239999999999995 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.417 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 62.399999999999999 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 51.549999999999997 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 74.420000000000002 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.340000000000003 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 74.519999999999996 109.46 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.109999999999999 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.009999999999998 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.040000000000006 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.522 ' HA ' HG21 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.439999999999998 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 73.299999999999997 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.319999999999993 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 52.539999999999999 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.743 ' HH ' HD22 ' A' ' 123' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 74.040000000000006 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 74.450000000000003 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.120000000000005 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.349999999999994 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.468 ' HD2' HG23 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.400000000000006 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.400000000000006 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 75.420000000000002 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.437 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.230000000000004 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.524 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 73.040000000000006 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 75.540000000000006 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.401 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.140000000000001 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.340000000000003 110.762 -177.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.120000000000005 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.530000000000001 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.685 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 74.400000000000006 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.721 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.340000000000003 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 73.109999999999999 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 73.230000000000004 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.439999999999998 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.636 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.150000000000006 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.200000000000003 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 73.299999999999997 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 73.209999999999994 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 40' ' ' VAL . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 73.040000000000006 110.644 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.439999999999998 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.685 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.150000000000006 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 74.450000000000003 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 74.239999999999995 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.109999999999999 111.807 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.427 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 75.329999999999998 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.340000000000003 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.424 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.450000000000003 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 75.120000000000005 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 74.400000000000006 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.572 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 75.0 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 75.5 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.230000000000004 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.572 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 75.349999999999994 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 70.329999999999998 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.420000000000002 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.99 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 63.240000000000002 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.517 ' O ' HG21 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.049999999999997 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 75.310000000000002 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.99 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.140000000000001 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.239999999999995 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.869 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 65.200000000000003 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 74.329999999999998 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 75.239999999999995 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.319999999999993 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.522 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 73.530000000000001 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 75.420000000000002 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.869 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.510000000000005 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.625 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.540000000000006 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 64.409999999999997 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB1' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 62.520000000000003 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 72.510000000000005 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.586 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 74.040000000000006 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.329999999999998 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 64.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.444 HG12 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 72.200000000000003 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.140000000000001 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.519999999999996 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.475 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 72.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.030000000000001 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.109999999999999 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.540000000000006 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 85' ' ' GLY . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 74.409999999999997 109.121 173.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.140000000000001 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.4 ' H ' ' C ' ' A' ' 83' ' ' ALA . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.140000000000001 110.804 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 75.439999999999998 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 71.219999999999999 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.499 HG21 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.129999999999995 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 73.219999999999999 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.738 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 74.140000000000001 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.592 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.439999999999998 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.586 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.594 ' HB ' HD12 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.530000000000001 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.625 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.549999999999997 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 72.129999999999995 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 75.349999999999994 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.583 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 63.439999999999998 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.310000000000002 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 75.430000000000007 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.530000000000001 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.510000000000005 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.019999999999996 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.010000000000005 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.510000000000005 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.749 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.219999999999999 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 74.319999999999993 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.239999999999995 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.230000000000004 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.721 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.109999999999999 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 74.540000000000006 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 64.450000000000003 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 73.450000000000003 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.416 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.120000000000005 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 74.519999999999996 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.552 HH11 ' HB1' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.140000000000001 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.552 ' HB1' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 74.420000000000002 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.566 HD11 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 75.230000000000004 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.72 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.030000000000001 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.340000000000003 112.229 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 61.229999999999997 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.420000000000002 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.743 HD22 ' HH ' ' A' ' 15' ' ' TYR . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 73.120000000000005 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.209999999999994 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 73.129999999999995 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.734 HD22 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 64.430000000000007 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 71.400000000000006 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . 0.446 HE21 ' HB3' ' A' ' 128' ' ' GLN . 0.9 OUTLIER -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 74.129999999999995 110.444 176.876 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 74.310000000000002 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.310000000000002 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 64.340000000000003 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 73.030000000000001 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.403 ' HB2' ' H ' ' A' ' 134' ' ' MET . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 75.120000000000005 112.048 -175.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.553 ' HB3' HG13 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 72.430000000000007 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.130000000000003 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.040000000000006 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.454 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 74.340000000000003 112.241 -176.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.581 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 71.049999999999997 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.581 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 72.219999999999999 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 72.150000000000006 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.475 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.420000000000002 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.329999999999998 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 75.200000000000003 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.491 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.310000000000002 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 74.219999999999999 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 73.299999999999997 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.734 ' HA ' HD22 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 74.540000000000006 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 75.510000000000005 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ILE . . . . . 0.446 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.42 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.2 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.14 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.02 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 54.4 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.12 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.21 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.45 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.45 113.069 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 61.4 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.75 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.23 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.23 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.45 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.23 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.34 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 63.22 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.23 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.12 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.52 ' N ' HD12 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 64.12 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.21 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 72.1 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.3 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.53 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.43 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.11 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 70.02 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.774 HD11 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 64.54 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.42 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.75 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.629 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 72.41 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.11 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.513 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 63.22 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.31 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.01 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.466 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.22 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.4 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.3 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 73.33 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.491 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.24 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.774 HG22 HD11 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 53.11 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.629 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 52.44 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 73.15 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 53.43 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.446 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 62.05 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.22 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.22 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 45.14 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 65.21 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.23 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.54 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.32 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 54.21 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 71.23 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.24 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.51 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 73.33 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.509 ' O ' HG23 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.13 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.11 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.1 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 64.34 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.04 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 71.02 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.21 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 51.43 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.23 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.599 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 52.34 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.663 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 54.23 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.599 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.12 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.742 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.51 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 22.12 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 54.43 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.53 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.34 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 61.43 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 63.31 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.582 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.15 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 53.21 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.813 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 60.21 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.13 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.428 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 64.31 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.428 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 89.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 62.53 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 70.51 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.21 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 62.13 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.44 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.35 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.813 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.43 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.14 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 62.52 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.598 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.11 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.55 HG13 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.43 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' HD13 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.34 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 70.13 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 74.11 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 64.23 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 64.14 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 53.04 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.588 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 62.24 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 52.42 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.23 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 64.23 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.43 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.489 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 64.31 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.583 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.35 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.663 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.23 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 71.54 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.51 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 63.14 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 71.44 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.625 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.13 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.547 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.53 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.531 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 71.21 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 54.13 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.403 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.11 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.23 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.605 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 74.02 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 65.03 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 74.24 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.42 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 73.14 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.44 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.727 ' HA ' HD23 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 72.42 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.12 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 63.33 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.3 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.43 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 62.32 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.55 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.03 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 41.32 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.588 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.04 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.14 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 53.41 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.3 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.15 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.22 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.581 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 72.32 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 70.41 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.3 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 70.21 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.43 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.53 HD13 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.3 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.535 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.34 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 64.1 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.502 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 64.4 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 65.44 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 71.2 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.836 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.44 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 52.41 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.1 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 64.4 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.54 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.24 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.458 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.42 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 71.02 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.52 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.11 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.4 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 71.41 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.608 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 70.02 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.815 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.43 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.52 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.652 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 55.13 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 53.25 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.42 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 71.12 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.4 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.44 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.51 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.743 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.53 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.681 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.21 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 70.3 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 71.22 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.35 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.966 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 71.31 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.485 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.33 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.966 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.44 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.961 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 64.3 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.52 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.961 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.02 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.542 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 62.22 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.658 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.43 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.474 HD13 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.55 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 54.13 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 73.33 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.859 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.32 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 28' ' ' ILE . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 70.52 110.743 -173.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.45 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.675 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.24 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.04 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 64.23 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.21 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.53 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.3 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.583 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 71.14 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.21 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 70.35 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.675 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 71.32 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.34 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.11 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.675 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.42 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.32 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 74.34 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.14 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 65.51 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 73.12 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.11 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.21 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 65.42 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.52 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.44 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.551 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 64.4 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.616 ' HB3' HG23 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.11 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.716 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.32 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.12 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 44.13 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.681 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 72.12 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.702 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.44 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.33 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.413 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.31 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.44 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 62.25 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 72.11 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.23 110.136 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 72.24 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 62.22 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.54 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 61.44 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.32 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.33 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.35 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.4 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 72.52 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.532 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.02 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.413 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.21 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.02 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.702 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 64.14 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 63.0 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.527 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.35 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.35 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.23 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.55 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 21.3 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.578 ' HG2' ' HB2' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 72.51 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.11 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.05 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.501 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 53.33 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.554 ' H ' ' HD3' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.24 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.22 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.43 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.42 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 73.33 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.1 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 71.33 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.522 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 62.03 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.52 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.836 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.44 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.55 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 72.44 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 52.45 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.2 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 72.14 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 63.52 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.662 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.05 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 72.4 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.516 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.44 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 51.01 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.402 ' CE2' HG22 ' A' ' 129' ' ' VAL . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 44.1 110.619 -174.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.527 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.32 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 127' ' ' PHE . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 53.2 110.514 -175.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 74.2 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.471 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 53.43 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.43 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.01 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 65.45 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.3 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 54.23 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 53.33 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.54 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.35 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.33 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' SER . . . . . 0.655 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 40.03 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 60.33 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.442 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.24 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 71.34 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.04 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 71.12 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.453 ' N ' HD12 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 52.05 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 24.32 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 62.12 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 71.3 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.04 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 70.22 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.666 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.54 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 53.13 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.31 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.35 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.667 HG21 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.34 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 73.13 111.388 -176.144 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.12 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 52.13 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 72.51 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.34 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.11 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 61.11 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.429 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 71.53 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.588 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 71.32 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.34 110.849 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 70.03 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.815 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.53 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 64.5 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.31 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.44 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.13 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 71.23 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.815 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.31 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 1.052 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.04 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.422 ' HB3' HG23 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.04 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.05 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.435 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.33 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.769 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 72.21 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.917 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 71.51 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 72.35 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.786 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 63.42 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.888 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.1 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.41 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 72.25 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.43 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.888 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 44.01 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.737 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 61.12 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 54.21 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 HG13 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 70.45 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.679 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 63.23 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 63.35 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG13 HG11 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 70.31 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.3 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.43 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 1.052 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.21 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 60.35 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 44.0 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.42 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.402 ' O ' ' HB3' ' A' ' 53' ' ' PHE . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.53 110.478 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 44.3 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 63.4 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 62.12 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 53.52 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.43 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.24 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.52 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.41 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.05 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.22 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.33 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 62.43 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.31 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.12 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 73.03 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.46 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.05 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 65.43 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.917 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 72.04 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.769 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.1 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 64.34 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.34 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.422 HG23 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 61.31 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 71.15 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 64.5 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.861 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.02 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 72.34 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.13 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 74.33 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.671 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.43 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.671 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.44 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 61.03 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.4 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 51.01 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.14 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 71.32 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 53.4 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.52 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 64.53 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.861 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.34 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 71.51 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.44 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.53 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.649 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 63.13 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 72.31 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 74.54 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.11 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 71.23 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.1 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.24 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 62.44 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.659 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.43 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.21 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.32 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 70.22 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.51 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 70.03 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.425 ' O ' HG23 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 61.2 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 62.31 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.666 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.3 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG21 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 60.1 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.01 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.441 ' HD3' ' C ' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 64.54 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.21 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.737 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 64.11 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.492 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 74.52 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 53.25 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 44.13 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.42 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.51 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.03 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.413 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.24 112.37 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.34 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 51.32 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 74.51 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.649 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 73.25 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 71.12 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.31 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 51.5 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.21 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.44 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 72.42 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' SER . . . . . 0.598 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.11 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.691 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 62.14 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.847 HD13 ' H ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.33 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 61.0 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.11 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 62.5 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 63.52 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.403 HG12 HD23 ' A' ' 146' ' ' LEU . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 74.23 112.302 -171.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.4 111.208 -175.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.31 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.403 HD23 HG12 ' A' ' 142' ' ' VAL . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.1 110.682 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 65.45 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.23 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.526 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.22 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 61.21 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.43 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ILE . . . . . 0.543 ' OXT' HD12 ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 74.2 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.649 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 54.32 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.32 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 71.22 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 45.54 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.14 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 74.41 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.02 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 70.13 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 72.42 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.35 110.047 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.44 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.44 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 63.45 109.618 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.33 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.455 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 71.14 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.12 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.12 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 71.31 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 71.03 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 72.2 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.02 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.32 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 72.11 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.686 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.04 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 72.4 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' VAL . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 62.22 109.236 171.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.44 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.668 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.91 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.23 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 63.0 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.13 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.24 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 71.22 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.567 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 71.5 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.52 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.12 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.434 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 71.21 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.24 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.406 HG22 HD11 ' A' ' 27' ' ' ILE . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.14 110.501 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.91 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.3 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 71.21 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 27' ' ' ILE . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.4 109.384 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.34 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.686 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 71.32 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 74.03 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 55.33 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 71.31 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' O ' HG23 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 64.44 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.33 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.14 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.681 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 53.11 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 45.24 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 64.43 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.869 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 73.43 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.478 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 64.45 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.05 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 71.35 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.59 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 65.04 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.517 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 61.35 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.41 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 53.04 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 44.34 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.623 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 65.34 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.15 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.412 ' H ' ' NH2' ' A' ' 106' ' ' ARG . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 55.22 108.414 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.59 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 63.22 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.668 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 72.25 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.681 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 72.31 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 61.13 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.32 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.574 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.44 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.24 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.826 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 55.31 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.31 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.35 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.32 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 54.24 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 72.23 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 73.55 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.15 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.77 ' HB3' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.01 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 52.25 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.34 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.52 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.77 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 60.41 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.616 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 63.11 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 72.13 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.42 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 91' ' ' LYS . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 70.34 110.483 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 71.02 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 72.45 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 128' ' ' GLN . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 74.52 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.2 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.12 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 63.12 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.2 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.422 ' HD2' ' O ' ' A' ' 66' ' ' GLU . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 53.23 112.125 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.43 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.21 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.31 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.579 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.51 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.451 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.24 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 73.5 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.412 ' NH2' ' H ' ' A' ' 67' ' ' CYS . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.33 111.077 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.688 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.34 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.31 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.21 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.688 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.41 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.649 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 62.31 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.406 ' HA ' ' C ' ' A' ' 1' ' ' MET . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 54.55 111.361 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.1 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.11 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 62.32 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.53 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.61 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.41 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.541 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.11 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 64.05 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.532 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.11 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.13 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 64.33 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.716 ' HA ' HD23 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 50.55 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 73.23 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 70.32 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.716 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 74.42 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.35 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.615 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 71.22 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 51.25 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 130' ' ' GLN . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.45 111.36 -177.718 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.11 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 62.31 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.4 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.53 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 73.03 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.41 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.11 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 63.23 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 73.32 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 65.3 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.14 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.409 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 74.34 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.54 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.14 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.4 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 74.33 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 63.45 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 72.23 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.4 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.607 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.43 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ILE . . . . . 0.417 ' OXT' HD12 ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 55.35 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.4 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.41 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.53 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 44.31 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.15 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.12 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.32 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 51.53 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.32 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.415 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 72.24 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.632 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 61.41 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.526 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 63.34 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 42.53 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 65.44 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.667 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.743 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 33.23 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 72.52 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 73.31 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.743 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.4 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.24 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.4 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.53 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.05 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.23 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 71.14 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 74.31 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.501 HD11 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.42 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.526 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.33 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.23 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 63.21 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 53.21 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.699 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.03 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.12 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.44 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.33 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.33 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 71.12 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.23 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.632 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 50.0 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG13 HD11 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 64.3 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 72.14 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.42 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 51.3 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.04 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 63.41 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.52 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.42 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 52.43 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.472 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 60.45 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 71.25 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.12 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 63.54 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 61.31 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.43 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.03 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.416 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 74.24 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 72.21 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 64.22 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 74.43 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 64.22 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.481 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.43 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.44 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.43 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.32 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 63.22 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.53 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.11 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.684 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.24 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 73.14 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.13 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.73 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.21 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 60.33 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.781 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 61.11 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.54 HG11 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 62.2 110.67 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 63.33 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 62.32 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 80' ' ' ARG . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 71.22 110.517 -175.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 63.34 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.33 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.42 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 51.11 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 71.34 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.53 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.539 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 62.12 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.581 HG22 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 73.31 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.535 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.781 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.12 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.51 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.73 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.52 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.706 HD11 HG23 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 64.14 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.684 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 71.24 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 73.22 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.532 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 65.32 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.21 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.3 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.02 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.493 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.05 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.478 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 64.41 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.34 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.44 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 74.42 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.43 110.399 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 63.14 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 71.33 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.407 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.33 110.688 175.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.4 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.12 110.954 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.52 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.44 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.476 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 32.03 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.52 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.12 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.524 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.12 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.43 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 64.24 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 52.34 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.526 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 74.34 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.23 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.752 ' HA ' HD23 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.45 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.51 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 62.23 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 63.04 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.496 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.14 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.51 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.706 HG23 HD11 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.44 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.513 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 72.5 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 74.22 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.22 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 70.23 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' SER . . . . . 0.413 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.14 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.419 ' HB2' ' OE2' ' A' ' 133' ' ' GLU . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.32 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.03 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.22 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 65.22 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.45 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.488 HG22 HG11 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 61.22 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.31 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.13 111.479 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.13 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.54 ' HG3' HG11 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.24 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.53 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 53.5 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.13 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 70.35 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.703 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 70.41 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 72.21 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 53.11 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 54.22 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.769 HG13 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.55 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 61.55 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.59 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.02 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.14 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 64.32 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.1 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.13 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.14 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 41.11 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 51.31 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.43 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.22 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.53 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.1 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.4 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.31 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.15 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.35 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.657 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.42 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.34 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.541 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 62.2 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.589 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 64.41 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.14 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.05 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.485 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 55.4 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.04 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.15 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.02 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.52 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.808 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 72.31 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 73.21 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.808 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 71.25 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.769 ' HB ' HG13 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.02 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.52 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.597 HD13 HD23 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.14 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 54.45 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.03 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.42 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 65.34 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.479 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.21 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.42 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.628 ' HD3' ' H ' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 63.4 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 70.41 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.49 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 53.43 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.21 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.444 ' O ' HG23 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 64.32 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 74.51 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 52.33 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 72.03 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.32 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.23 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.31 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.406 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.32 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.51 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 64.03 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.23 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 63.13 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.13 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.35 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.4 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.4 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 44.24 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.02 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.485 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 64.31 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.51 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.04 112.083 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 52.45 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.52 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.449 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.55 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 51.14 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.808 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 64.42 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 64.44 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' SER . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 73.23 111.328 -175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.438 ' HB ' ' HG2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 73.4 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' H ' HG12 ' A' ' 78' ' ' VAL . 22.4 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 70.11 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.43 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.52 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 55.3 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.14 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.01 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.21 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 77' ' ' THR . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.45 109.748 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 55.43 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 73.44 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.808 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 26.2 p-10 -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.42 110.284 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.559 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 64.42 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.34 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.461 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 64.42 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.64 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 65.24 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 54.31 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.484 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 73.4 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.44 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.11 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.12 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.13 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.21 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.54 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.44 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.41 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 65.32 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.3 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 65.43 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.563 ' HB3' HD13 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.23 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 96' ' ' GLN . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.02 110.559 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.703 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.43 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.41 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.34 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.54 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.23 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.42 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.597 HD23 HD13 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.12 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.02 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.3 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 65.11 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.589 HD22 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.05 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 54.05 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.12 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.34 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 65.24 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.32 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.51 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.64 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.44 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.33 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.53 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.2 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 51.55 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.52 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.41 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 62.44 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 72.34 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 73.44 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 63.54 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 53.33 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.517 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.35 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 73.14 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 43.03 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 54.12 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.517 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 61.22 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.14 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.24 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 71.21 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.31 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 64.23 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.34 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.559 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 54.31 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.617 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 73.23 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 54.15 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.592 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.23 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.32 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 71.4 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 45.13 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.32 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.21 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 71.35 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 73.22 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 70.44 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.51 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.528 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.52 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.23 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 63.1 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.643 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 73.42 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 72.11 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.54 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.833 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 73.42 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.41 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 61.2 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 73.53 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.56 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 62.0 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 71.53 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.833 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.13 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.01 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.651 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.11 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.61 HD11 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 72.23 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.42 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.534 ' HB3' HG22 ' A' ' 38' ' ' ILE . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.11 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.636 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 62.11 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 62.33 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.24 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 70.11 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.22 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.52 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.31 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.497 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 43.51 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.786 HD13 HD23 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.14 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.24 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.61 HG22 HD11 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.35 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 70.15 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.817 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 55.34 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.34 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 20.12 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.437 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 61.12 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.13 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.04 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 70.32 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.25 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 61.3 110.814 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 73.01 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.24 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 61.1 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.32 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.817 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.32 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.3 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.41 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.52 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 44.23 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.03 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.15 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.22 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 60.21 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 62.31 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.03 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 62.43 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 71.12 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.42 108.661 175.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 51.13 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 51.44 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.624 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.24 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.844 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.21 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.13 109.706 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.43 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.34 109.719 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 62.52 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 63.23 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.05 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 63.24 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.04 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.1 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 60.33 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.1 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.514 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.22 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.11 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.21 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 62.03 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.11 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.619 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.53 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.501 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 64.44 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.12 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.669 HD11 HG23 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 72.35 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.34 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 55.35 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.43 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.52 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 73.23 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 61.04 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.43 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 50.21 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.685 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 62.04 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 54.22 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.32 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.685 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 73.13 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 73.15 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.1 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.33 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.24 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.24 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.13 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.41 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 115' ' ' ARG . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.53 111.05 -176.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.23 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.786 HD23 HD13 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.02 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.59 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 61.4 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 45.0 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 44.54 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 64.53 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.55 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.41 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.576 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.35 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.03 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 71.11 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.44 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 71.14 110.188 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.669 HG23 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 71.24 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.03 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.41 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.22 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 70.12 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.495 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.12 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.11 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.532 ' HB2' ' HB1' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.42 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.22 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ASP . . . . . 0.542 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.12 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 73.44 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.04 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 61.21 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 61.13 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.467 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.23 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 65.43 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.15 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.32 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 64.23 109.38 175.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.15 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.44 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.501 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 17.7 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.3 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 72.31 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.34 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.863 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.32 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.41 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 52.22 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 72.23 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.532 HG13 HG22 ' A' ' 36' ' ' THR . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 71.12 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.24 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 71.44 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.24 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 71.45 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.24 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 71.51 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.33 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 51.12 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.03 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.54 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 53.13 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 71.15 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 63.11 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 64.43 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 71.23 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.03 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 64.12 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 52.21 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.03 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 60.23 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 72.54 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 43.15 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 64.01 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 64.04 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.604 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 70.3 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.725 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.32 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.42 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.43 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.31 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.532 HG22 HG13 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.24 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 63.0 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 63.22 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.544 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 64.22 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.4 HG22 HD11 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 62.23 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 62.11 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 72.24 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.446 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.14 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.12 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.55 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.23 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 73.21 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.3 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.43 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 71.54 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.23 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.53 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.01 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' HE2' ' HH ' ' A' ' 97' ' ' TYR . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 73.42 110.388 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 64.22 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.566 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.13 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.35 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.491 ' HA ' HH22 ' A' ' 68' ' ' ARG . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.01 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 73.15 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.4 HD23 ' CZ ' ' A' ' 68' ' ' ARG . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 74.42 111.661 -177.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 45.33 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.41 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 53.43 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 54.13 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.33 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 73.25 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.11 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.34 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.13 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB2' HG23 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 53.22 110.499 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.15 109.608 176.121 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.22 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 62.41 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG22 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 60.42 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.668 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 70.03 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.415 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 70.33 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 64.04 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 65.24 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.03 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 33.04 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 64.32 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.21 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.668 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.43 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.34 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.403 HG22 ' HB ' ' A' ' 77' ' ' THR . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.416 177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.14 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.63 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.45 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 71.15 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.22 110.534 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.538 ' HB ' HD13 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.12 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.416 ' HD1' ' HB2' ' A' ' 71' ' ' ALA . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.43 109.416 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 52.43 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.674 ' HA ' ' HB3' ' A' ' 69' ' ' TYR . 24.7 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 61.35 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.32 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 62.3 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.22 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 71.44 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.31 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 43.41 111.303 -177.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.15 111.754 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.3 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.656 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 72.44 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 70.23 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.563 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 53.33 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 53.44 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.23 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.05 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.863 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.34 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 62.15 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.33 111.7 -178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 52.4 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 52.14 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 72.02 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 73.33 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 52.11 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.453 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 73.21 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 63.24 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.51 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.798 ' HA ' HD23 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 63.12 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 65.12 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 45.3 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.798 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.11 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 71.45 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.1 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.41 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 65.22 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 54.31 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.461 ' CB ' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 70.24 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.02 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 55.23 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' SER . . . . . 0.459 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 51.25 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.14 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 62.44 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.22 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.12 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.01 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 70.02 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.31 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 72.05 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.21 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.31 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 51.52 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.533 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 42.24 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.14 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.14 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.533 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.24 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 151' ' ' ARG . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 72.1 111.535 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 71.05 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.967 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 72.45 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.24 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.05 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.22 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.492 HG12 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.03 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.611 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.21 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 53.25 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 60.44 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 63.42 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 44.42 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.479 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.52 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 61.12 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.408 HD22 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.21 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.52 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.678 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.12 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 55.1 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.21 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.23 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 71.13 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 50.42 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.42 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 65.52 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.43 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.05 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.12 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HE1' ' HB1' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.3 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 61.33 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.04 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HE1' HD22 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.31 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.31 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.55 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.34 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.32 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.05 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.463 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.14 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.1 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.43 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.531 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.35 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.13 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.43 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 64.23 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.01 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 40.13 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 62.54 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 71.23 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 64.03 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 42.12 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.44 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.636 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.1 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.41 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.31 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 70.3 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 64.4 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.41 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 65.32 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.58 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 52.21 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.57 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 42.03 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.23 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 72.43 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 63.14 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 63.42 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 52.51 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 64.54 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.51 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.451 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 50.15 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.548 ' N ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.31 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.3 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.54 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.53 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.3 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.861 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.34 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 43.21 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.31 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.41 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.24 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 43.34 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.632 ' H ' HG12 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.45 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.791 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.33 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.03 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.32 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.02 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.44 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.11 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.22 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 65.41 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.35 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.519 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.23 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.745 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.41 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.861 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.03 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.483 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 63.21 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 61.35 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 60.42 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.23 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.12 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.2 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.539 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 64.32 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.11 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 74.11 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 71.34 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 64.43 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.35 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.14 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.3 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 62.33 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 73.22 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 54.13 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.14 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 71.13 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.967 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.12 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.591 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 50.23 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 35.23 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.53 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.21 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 52.55 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.827 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 64.25 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.54 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.34 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.44 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.34 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.827 HD12 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 55.44 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.24 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.51 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 64.43 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 72.22 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.54 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 64.11 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.1 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 71.31 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.11 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 64.44 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.34 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 64.14 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.43 110.82 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.543 ' O ' HD13 ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.43 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.35 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.21 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.4 111.616 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.4 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.662 HG12 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.11 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 53.1 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.54 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.43 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.662 HD23 HG12 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.24 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.453 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 54.22 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' SER . . . . . 0.791 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.23 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.44 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.45 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 72.31 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 54.41 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 62.24 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.24 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 51.22 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 41.23 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 63.41 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.34 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 120' ' ' SER . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 63.13 109.46 171.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.11 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.01 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.04 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HA ' HG23 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.13 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 64.45 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.32 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 43.32 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.542 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 64.02 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 73.2 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.12 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.35 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.477 ' HD2' HG21 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.4 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.4 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.63 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 71.14 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.436 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.23 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.527 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 72.53 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 62.32 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.14 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.34 110.762 -177.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.12 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.05 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.707 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 63.15 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.74 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.34 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.446 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 72.34 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.709 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 72.32 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.44 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.709 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.15 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.2 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 53.3 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.456 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 63.13 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 65.21 110.644 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.44 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.707 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.15 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 70.11 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 71.43 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.4 ' HA3' ' CZ ' ' A' ' 26' ' ' TYR . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.11 111.807 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 71.01 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.34 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.45 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 63.12 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 72.23 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 63.54 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 53.23 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.01 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 65.1 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 65.12 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.42 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 1.016 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 55.14 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.529 ' O ' HG23 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.05 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 73.04 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 1.016 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.14 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.24 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.899 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 54.52 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 70.42 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 70.51 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.32 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.559 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 72.42 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 71.54 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.14 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.899 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.51 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.54 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 45.21 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 53.5 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 52.4 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.583 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 60.33 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.33 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 51.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.42 HG11 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 55.23 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.14 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.52 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.486 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 65.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.486 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.03 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.11 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.54 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 21.2 109.121 173.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.14 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.14 110.804 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 74.43 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 64.33 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.13 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 72.25 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 70.32 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.597 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.44 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.583 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 50.54 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.641 ' HB ' HD13 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.42 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.637 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.55 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 62.04 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 65.45 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.604 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 62.25 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.31 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 72.1 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.53 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.51 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.02 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.01 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.51 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.812 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.22 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 72.42 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.24 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.23 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.74 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.11 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 73.33 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 34.02 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 65.23 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.12 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 71.22 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.537 HH11 ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.14 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ALA . . . . . 0.537 ' HB2' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 64.33 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 62.33 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.748 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.03 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.402 ' HB3' HG21 ' A' ' 7' ' ' VAL . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.34 112.229 -174.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 60.54 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.42 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.748 HD12 ' HA ' ' A' ' 118' ' ' LYS . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 64.53 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 63.14 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 44.25 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 43.34 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 16.1 tm0? -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 62.5 110.444 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.676 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 62.4 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.31 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 63.43 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 60.11 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 71.4 112.048 -175.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.572 ' HB3' HG11 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 54.23 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.13 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.04 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ASP . . . . . 0.458 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.407 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 64.41 112.241 -176.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.584 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 54.54 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 71.31 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 61.23 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.23 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.33 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 72.35 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.506 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.31 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 63.13 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 61.42 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HA ' HD21 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 52.1 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 73.22 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ILE . . . . . 0.457 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.42 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.2 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.14 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.02 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 54.4 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.12 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.21 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.45 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.45 113.069 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 61.4 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.75 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.23 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.23 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.45 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.23 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.34 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 63.22 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.23 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.12 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.52 ' N ' HD12 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 64.12 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.21 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 72.1 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.3 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.53 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.43 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.11 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 70.02 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.774 HD11 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 64.54 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.42 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.75 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.629 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 72.41 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.11 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.513 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 63.22 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.31 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.01 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.466 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.22 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.4 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.3 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 73.33 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.491 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.24 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.774 HG22 HD11 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 53.11 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.629 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 52.44 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 73.15 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 53.43 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.446 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 62.05 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.22 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.22 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 45.14 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 65.21 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.23 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.54 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.32 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 54.21 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 71.23 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.24 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.51 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 73.33 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.509 ' O ' HG23 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.13 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.11 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.1 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 64.34 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.04 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 71.02 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.21 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 51.43 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.23 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.599 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 52.34 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.663 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 54.23 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.599 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.12 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.742 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.51 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 22.12 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 54.43 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.53 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.34 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 61.43 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 63.31 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.582 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.15 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 53.21 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.813 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 60.21 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.13 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.428 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 64.31 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.428 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 89.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 62.53 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 70.51 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.21 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 62.13 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.44 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.35 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.813 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.43 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.14 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 62.52 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.598 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.11 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.55 HG13 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.43 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' HD13 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.34 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 70.13 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 74.11 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 64.23 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 64.14 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 53.04 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.588 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 62.24 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 52.42 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.23 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 64.23 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.43 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.489 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 64.31 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.583 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.35 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.663 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.23 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 71.54 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.51 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 63.14 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 71.44 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.625 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.13 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.547 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.53 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.531 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 71.21 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 54.13 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.403 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.11 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.23 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.605 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 74.02 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 65.03 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 74.24 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.42 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 73.14 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.44 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.727 ' HA ' HD23 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 72.42 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.12 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 63.33 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.3 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.43 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 62.32 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.55 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.03 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 41.32 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.588 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.04 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.14 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 53.41 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.3 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.15 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.22 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.581 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 72.32 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 70.41 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.3 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 70.21 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.43 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.53 HD13 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.3 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.535 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.34 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 64.1 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.502 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 64.4 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 65.44 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 71.2 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.836 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.44 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 52.41 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.1 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 64.4 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.54 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.24 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.458 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.42 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 71.02 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.52 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.11 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.4 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 71.41 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.608 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 70.02 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.815 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.43 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.52 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.652 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 55.13 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 53.25 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.42 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 71.12 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.4 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.44 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.51 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.743 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.53 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.681 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.21 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 70.3 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 71.22 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.35 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.966 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 71.31 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.485 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.33 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.966 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.44 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.961 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 64.3 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.52 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.961 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.02 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.542 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 62.22 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.658 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.43 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.474 HD13 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.55 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 54.13 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 73.33 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.859 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.32 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 28' ' ' ILE . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 70.52 110.743 -173.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.45 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.675 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.24 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.04 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 64.23 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.21 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.53 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.3 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.583 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 71.14 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.21 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 70.35 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.675 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 71.32 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.34 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.11 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.675 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.42 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.32 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 74.34 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.14 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 65.51 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 73.12 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.11 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.21 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 65.42 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.52 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.44 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.551 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 64.4 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.616 ' HB3' HG23 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.11 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.716 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.32 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.12 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 44.13 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.681 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 72.12 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.702 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.44 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.33 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.413 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.31 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.44 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 62.25 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 72.11 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.23 110.136 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 72.24 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 62.22 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.54 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 61.44 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.32 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.33 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.35 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.4 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 72.52 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.532 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.02 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.413 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.21 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.02 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.702 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 64.14 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 63.0 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.527 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.35 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.35 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.23 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.55 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 21.3 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.578 ' HG2' ' HB2' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 72.51 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.11 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.05 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.501 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 53.33 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.554 ' H ' ' HD3' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.24 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.22 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.43 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.42 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 73.33 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.1 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 71.33 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.522 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 62.03 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.52 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.836 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.44 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.55 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 72.44 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 52.45 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.2 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 72.14 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 63.52 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.662 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.05 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 72.4 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.516 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.44 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 51.01 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.402 ' CE2' HG22 ' A' ' 129' ' ' VAL . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 44.1 110.619 -174.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.527 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.32 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 127' ' ' PHE . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 53.2 110.514 -175.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 74.2 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.471 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 53.43 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.43 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.01 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 65.45 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.3 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 54.23 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 53.33 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.54 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.35 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.33 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.655 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 40.03 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 60.33 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.442 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.24 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 71.34 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.04 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 71.12 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.453 ' N ' HD12 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 52.05 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 24.32 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 62.12 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 71.3 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.04 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 70.22 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.666 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.54 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 53.13 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.31 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.35 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.667 HG21 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.34 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 73.13 111.388 -176.144 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.12 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 52.13 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 72.51 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.34 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.11 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 61.11 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.429 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 71.53 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.588 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 71.32 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.34 110.849 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 70.03 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.815 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.53 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 64.5 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.31 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.44 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.13 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 71.23 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.815 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.31 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 1.052 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.04 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.422 ' HB3' HG23 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.04 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.05 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.435 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.33 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.769 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 72.21 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.917 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 71.51 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 72.35 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.786 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 63.42 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.888 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.1 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.41 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 72.25 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.43 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.888 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 44.01 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.737 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 61.12 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 54.21 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 HG13 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 70.45 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.679 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 63.23 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 63.35 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG13 HG11 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 70.31 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.3 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.43 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 1.052 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.21 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 60.35 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 44.0 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.42 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.402 ' O ' ' HB3' ' A' ' 53' ' ' PHE . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.53 110.478 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 44.3 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 63.4 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 62.12 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 53.52 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.43 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.24 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.52 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.41 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.05 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.22 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.33 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 62.43 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.31 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.12 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 73.03 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.46 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.05 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 65.43 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.917 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 72.04 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.769 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.1 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 64.34 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.34 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.422 HG23 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 61.31 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 71.15 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 64.5 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.861 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.02 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 72.34 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.13 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 74.33 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.671 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.43 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.671 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.44 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 61.03 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.4 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 51.01 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.14 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 71.32 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 53.4 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.52 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 64.53 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.861 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.34 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 71.51 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.44 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.53 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.649 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 63.13 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 72.31 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 74.54 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.11 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 71.23 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.1 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.24 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 62.44 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.659 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.43 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.21 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.32 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 70.22 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.51 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 70.03 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.425 ' O ' HG23 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 61.2 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 62.31 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.666 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.3 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG21 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 60.1 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.01 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.441 ' HD3' ' C ' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 64.54 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.21 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.737 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 64.11 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.492 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 74.52 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 53.25 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 44.13 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.42 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.51 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.03 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.413 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.24 112.37 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.34 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 51.32 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 74.51 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.649 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 73.25 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 71.12 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.31 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 51.5 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.21 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.44 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 72.42 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.598 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.11 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.691 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 62.14 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.847 HD13 ' H ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.33 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 61.0 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.11 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 62.5 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 63.52 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.403 HG12 HD23 ' A' ' 146' ' ' LEU . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 74.23 112.302 -171.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.4 111.208 -175.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.31 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.403 HD23 HG12 ' A' ' 142' ' ' VAL . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.1 110.682 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 65.45 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.23 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.526 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.22 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 61.21 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.43 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ILE . . . . . 0.543 ' OXT' HD12 ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 74.2 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.649 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 54.32 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.32 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 71.22 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 45.54 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.14 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 74.41 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.02 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 70.13 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 72.42 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.35 110.047 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.44 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.44 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 63.45 109.618 175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.33 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.455 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 71.14 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.12 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.12 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 71.31 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 71.03 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 72.2 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.02 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.32 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 72.11 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.686 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.04 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 72.4 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' VAL . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 62.22 109.236 171.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.44 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.668 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.91 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.23 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 63.0 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.13 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.24 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 71.22 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.567 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 71.5 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.52 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.12 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.434 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 71.21 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.24 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.406 HG22 HD11 ' A' ' 27' ' ' ILE . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.14 110.501 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.91 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.3 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 71.21 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 27' ' ' ILE . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.4 109.384 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.34 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.686 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 71.32 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 74.03 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 55.33 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 71.31 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' O ' HG23 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 64.44 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.33 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.14 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.681 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 53.11 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 45.24 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 64.43 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.869 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 73.43 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.478 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 64.45 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.05 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 71.35 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.59 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 65.04 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.517 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 61.35 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.41 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 53.04 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 44.34 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.623 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 65.34 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.15 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.412 ' H ' ' NH2' ' A' ' 106' ' ' ARG . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 55.22 108.414 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.59 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 63.22 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.668 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 72.25 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.681 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 72.31 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 61.13 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.32 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.574 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.44 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.24 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.826 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 55.31 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.31 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.35 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.32 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 54.24 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 72.23 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 73.55 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.15 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.77 ' HB3' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.01 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 52.25 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.34 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.52 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.77 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 60.41 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.616 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 63.11 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 72.13 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.42 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 91' ' ' LYS . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 70.34 110.483 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 71.02 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 72.45 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 128' ' ' GLN . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 74.52 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.2 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.12 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 63.12 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.2 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.422 ' HD2' ' O ' ' A' ' 66' ' ' GLU . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 53.23 112.125 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.43 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.21 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.31 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.579 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.51 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.451 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.24 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 73.5 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.412 ' NH2' ' H ' ' A' ' 67' ' ' CYS . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.33 111.077 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.688 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.34 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.31 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.21 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.688 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.41 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.649 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 62.31 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.406 ' HA ' ' C ' ' A' ' 1' ' ' MET . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 54.55 111.361 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.1 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.11 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 62.32 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.53 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.61 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.41 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.541 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.11 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 64.05 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.532 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.11 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.13 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 64.33 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.716 ' HA ' HD23 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 50.55 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 73.23 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 70.32 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.716 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 74.42 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.35 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.615 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 71.22 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 51.25 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 130' ' ' GLN . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.45 111.36 -177.718 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.11 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 62.31 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.4 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.53 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 73.03 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.41 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.11 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 63.23 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 73.32 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 65.3 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.14 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.409 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 74.34 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.54 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.14 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.4 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 74.33 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 63.45 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 72.23 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.4 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.607 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.43 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ILE . . . . . 0.417 ' OXT' HD12 ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 55.35 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.41 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.53 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 44.31 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.15 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.12 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.32 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 51.53 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.32 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.415 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 72.24 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.632 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 61.41 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.526 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 63.34 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 42.53 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 65.44 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.667 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.743 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 33.23 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 72.52 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 73.31 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.743 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.4 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.24 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.4 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.53 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.05 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.23 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 71.14 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 74.31 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.501 HD11 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.42 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.526 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.33 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.23 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 63.21 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 53.21 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.699 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.03 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.12 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.44 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.33 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.33 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 71.12 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.23 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.632 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 50.0 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG13 HD11 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 64.3 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 72.14 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.42 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 51.3 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.04 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 63.41 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.52 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.42 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 52.43 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.472 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 60.45 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 71.25 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.12 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 63.54 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 61.31 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.43 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.03 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.416 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 74.24 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 72.21 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 64.22 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 74.43 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 64.22 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.481 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.43 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.44 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.43 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.32 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 63.22 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.53 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.11 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.684 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.24 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 73.14 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.13 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.73 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.21 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 60.33 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.781 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 61.11 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.54 HG11 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 62.2 110.67 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 63.33 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 62.32 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 80' ' ' ARG . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 71.22 110.517 -175.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 63.34 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.33 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.42 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 51.11 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 71.34 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.53 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.539 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 62.12 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.581 HG22 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 73.31 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.535 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.781 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.12 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.51 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.73 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.52 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.706 HD11 HG23 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 64.14 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.684 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 71.24 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 73.22 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.532 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 65.32 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.21 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.3 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.02 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.493 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.05 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.478 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 64.41 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.34 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.44 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 74.42 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.43 110.399 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 63.14 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 71.33 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.407 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.33 110.688 175.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.4 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.12 110.954 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.52 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.44 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.476 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 32.03 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.52 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.12 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.524 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.12 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.43 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 64.24 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 52.34 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.526 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 74.34 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.23 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.752 ' HA ' HD23 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.45 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.51 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 62.23 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 63.04 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.496 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.14 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.51 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.706 HG23 HD11 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.44 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.513 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 72.5 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 74.22 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.22 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 70.23 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.413 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.14 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.419 ' HB2' ' OE2' ' A' ' 133' ' ' GLU . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.32 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.03 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.22 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 65.22 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.45 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.488 HG22 HG11 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 61.22 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.31 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.13 111.479 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.13 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.54 ' HG3' HG11 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.24 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.53 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 53.5 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.13 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 70.35 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.703 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 70.41 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 72.21 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 53.11 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 54.22 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.769 HG13 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.55 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 61.55 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.59 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.02 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.14 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 64.32 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.1 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.13 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.14 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 41.11 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 51.31 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.43 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.22 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.53 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.1 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.4 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.31 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.15 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.35 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.657 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.42 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.34 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.541 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 62.2 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.589 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 64.41 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.14 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.05 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.485 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 55.4 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.04 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.15 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.02 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.52 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.808 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 72.31 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 73.21 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.808 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 71.25 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.769 ' HB ' HG13 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.02 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.52 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.597 HD13 HD23 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.14 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 54.45 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.03 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.42 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 65.34 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.479 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.21 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.42 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.628 ' HD3' ' H ' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 63.4 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 70.41 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.49 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 53.43 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.21 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.444 ' O ' HG23 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 64.32 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 74.51 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 52.33 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 72.03 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.32 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.23 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.31 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.406 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.32 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.51 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 64.03 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.23 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 63.13 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.13 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.35 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.4 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.4 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 44.24 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.02 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.485 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 64.31 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.51 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.04 112.083 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 52.45 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.52 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.449 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.55 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 51.14 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.808 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 64.42 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 64.44 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' SER . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 73.23 111.328 -175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.438 ' HB ' ' HG2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 73.4 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' H ' HG12 ' A' ' 78' ' ' VAL . 22.4 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 70.11 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.43 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.52 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 55.3 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.14 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.01 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.21 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 77' ' ' THR . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.45 109.748 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 55.43 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 73.44 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.808 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 26.2 p-10 -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.42 110.284 176.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.559 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 64.42 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.34 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.461 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 64.42 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.64 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 65.24 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 54.31 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.484 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 73.4 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.44 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.11 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.12 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.13 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.21 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.54 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.44 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.41 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 65.32 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.3 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 65.43 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.563 ' HB3' HD13 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.23 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 96' ' ' GLN . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.02 110.559 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.703 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.43 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.41 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.34 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.54 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.23 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.42 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.597 HD23 HD13 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.12 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.02 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.3 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 65.11 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.589 HD22 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.05 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 54.05 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.12 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.34 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 65.24 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.32 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.51 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.64 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.44 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.33 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.53 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.2 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 51.55 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.52 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.41 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 62.44 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 72.34 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 73.44 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 63.54 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 53.33 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.517 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.35 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 73.14 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 43.03 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 54.12 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.517 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 61.22 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.14 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.24 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 71.21 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.31 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 64.23 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.34 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.559 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 54.31 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.617 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 73.23 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 54.15 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.592 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.23 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.32 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 71.4 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 45.13 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.32 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.21 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 71.35 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 73.22 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 70.44 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.51 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.528 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.52 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.23 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 63.1 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.643 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 73.42 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 72.11 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.54 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.833 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 73.42 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.41 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 61.2 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 73.53 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.56 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 62.0 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 71.53 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.833 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.13 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.01 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.651 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.11 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.61 HD11 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 72.23 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.42 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.534 ' HB3' HG22 ' A' ' 38' ' ' ILE . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.11 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.636 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 62.11 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 62.33 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.24 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 70.11 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.22 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.52 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.31 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.497 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 43.51 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.786 HD13 HD23 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.14 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.24 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.61 HG22 HD11 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.35 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 70.15 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.817 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 55.34 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.34 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 20.12 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.437 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 61.12 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.13 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.04 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 70.32 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.25 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 61.3 110.814 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 73.01 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.24 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 61.1 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.32 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.817 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.32 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.3 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.41 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.52 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 44.23 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.03 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.15 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.22 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 60.21 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 62.31 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.03 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 62.43 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 71.12 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.42 108.661 175.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 51.13 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 51.44 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.624 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.24 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.844 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.21 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.13 109.706 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.43 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.34 109.719 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 62.52 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 63.23 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.05 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 63.24 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.04 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.1 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 60.33 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.1 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.514 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.22 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.11 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.21 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 62.03 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.11 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.619 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.53 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.501 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 64.44 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.12 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.669 HD11 HG23 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 72.35 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.34 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 55.35 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.43 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.52 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 73.23 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 61.04 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.43 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 50.21 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.685 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 62.04 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 54.22 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.32 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.685 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 73.13 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 73.15 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.1 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.33 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.24 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.24 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.13 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.41 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 115' ' ' ARG . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.53 111.05 -176.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.23 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.786 HD23 HD13 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.02 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.59 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 61.4 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 45.0 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 44.54 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 64.53 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.55 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.41 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.576 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.35 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.03 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 71.11 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.44 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 71.14 110.188 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.669 HG23 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 71.24 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.03 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.41 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.22 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 70.12 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.495 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.12 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.11 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.532 ' HB2' ' HB1' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.42 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.22 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.542 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.12 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 73.44 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.04 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 61.21 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 61.13 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.467 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.23 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 65.43 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.15 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.32 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 64.23 109.38 175.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.15 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.44 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.501 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 17.7 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.3 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 72.31 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.34 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.863 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.32 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.41 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 52.22 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 72.23 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.532 HG13 HG22 ' A' ' 36' ' ' THR . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 71.12 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.24 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 71.44 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.24 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 71.45 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.24 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 71.51 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.33 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 51.12 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.03 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.54 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 53.13 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 71.15 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 63.11 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 64.43 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 71.23 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.03 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 64.12 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 52.21 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.03 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 60.23 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 72.54 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 43.15 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 64.01 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 64.04 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.604 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 70.3 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.725 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.32 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.42 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.43 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.31 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.532 HG22 HG13 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.24 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 63.0 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 63.22 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.544 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 64.22 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.4 HG22 HD11 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 62.23 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 62.11 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 72.24 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.446 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.14 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.12 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.55 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.23 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 73.21 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.3 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.43 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 71.54 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.23 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.53 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.01 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' HE2' ' HH ' ' A' ' 97' ' ' TYR . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 73.42 110.388 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 64.22 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.566 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.13 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.35 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.491 ' HA ' HH22 ' A' ' 68' ' ' ARG . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.01 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 73.15 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.4 HD23 ' CZ ' ' A' ' 68' ' ' ARG . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 74.42 111.661 -177.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 45.33 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.41 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 53.43 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 54.13 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.33 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 73.25 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.11 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.34 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.13 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB2' HG23 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 53.22 110.499 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.15 109.608 176.121 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.22 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 62.41 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG22 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 60.42 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.668 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 70.03 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.415 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 70.33 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 64.04 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 65.24 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.03 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 33.04 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 64.32 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.21 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.668 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.43 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.34 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.403 HG22 ' HB ' ' A' ' 77' ' ' THR . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.416 177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.14 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.63 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.45 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 71.15 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.22 110.534 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.538 ' HB ' HD13 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.12 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.416 ' HD1' ' HB2' ' A' ' 71' ' ' ALA . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.43 109.416 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 52.43 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.674 ' HA ' ' HB3' ' A' ' 69' ' ' TYR . 24.7 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 61.35 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.32 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 62.3 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.22 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 71.44 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.31 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 43.41 111.303 -177.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.15 111.754 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.3 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.656 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 72.44 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 70.23 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.563 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 53.33 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 53.44 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.23 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.05 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.863 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.34 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 62.15 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.33 111.7 -178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 52.4 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 52.14 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 72.02 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 73.33 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 52.11 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.453 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 73.21 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 63.24 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.51 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.798 ' HA ' HD23 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 63.12 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 65.12 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 45.3 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.798 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.11 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 71.45 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.1 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.41 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 65.22 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 54.31 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.461 ' CB ' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 70.24 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.02 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 55.23 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.459 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 51.25 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.14 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 62.44 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.22 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.12 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.01 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 70.02 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.31 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 72.05 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.21 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.31 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 51.52 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.533 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 42.24 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.14 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.14 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.533 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.24 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 151' ' ' ARG . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 72.1 111.535 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 71.05 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.967 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 72.45 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.24 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.05 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.22 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.492 HG12 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.03 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.611 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.21 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 53.25 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 60.44 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 63.42 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 44.42 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.479 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.52 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 61.12 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.408 HD22 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.21 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.52 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.678 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.12 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 55.1 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.21 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.23 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 71.13 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 50.42 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.42 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 65.52 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.43 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.05 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.12 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HE1' ' HB1' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.3 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 61.33 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.04 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HE1' HD22 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.31 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.31 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.55 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.34 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.32 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.05 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.463 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.14 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.1 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.43 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.531 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.35 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.13 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.43 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 64.23 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.01 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 40.13 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 62.54 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 71.23 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 64.03 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 42.12 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.44 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.636 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.1 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.41 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.31 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 70.3 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 64.4 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.41 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 65.32 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.58 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 52.21 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.57 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 42.03 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.23 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 72.43 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 63.14 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 63.42 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 52.51 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 64.54 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.51 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.451 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 50.15 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.548 ' N ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.31 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.3 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.54 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.53 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.3 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.861 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.34 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 43.21 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.31 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.41 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.24 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 43.34 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.632 ' H ' HG12 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.45 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.791 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.33 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.03 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.32 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.02 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.44 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.11 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.22 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 65.41 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.35 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.519 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.23 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.745 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.41 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.861 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.03 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.483 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 63.21 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 61.35 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 60.42 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.23 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.12 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.2 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.539 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 64.32 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.11 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 74.11 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 71.34 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 64.43 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.35 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.14 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.3 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 62.33 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 73.22 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 54.13 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.14 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 71.13 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.967 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.12 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.591 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 50.23 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 35.23 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.53 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.21 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 52.55 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.827 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 64.25 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.54 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.34 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.44 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.34 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.827 HD12 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 55.44 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.24 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.51 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 64.43 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 72.22 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.54 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 64.11 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.1 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 71.31 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.11 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 64.44 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.34 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 64.14 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.43 110.82 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.543 ' O ' HD13 ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.43 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.35 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.21 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.4 111.616 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.4 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.662 HG12 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.11 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 53.1 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.54 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.43 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.662 HD23 HG12 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.24 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.453 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 54.22 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' SER . . . . . 0.791 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.23 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.44 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.45 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 72.31 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 54.41 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 62.24 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.24 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 51.22 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 41.23 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 63.41 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.34 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 120' ' ' SER . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 63.13 109.46 171.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.11 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.01 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.04 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HA ' HG23 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.13 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 64.45 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.32 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 43.32 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.542 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 64.02 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 73.2 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.12 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.35 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.477 ' HD2' HG21 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.4 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.4 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.63 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 71.14 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.436 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.23 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.527 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 72.53 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 62.32 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.14 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.34 110.762 -177.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.12 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.05 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.707 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 63.15 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.74 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.34 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.446 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 72.34 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.709 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 72.32 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.44 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.709 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.15 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.2 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 53.3 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.456 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 63.13 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 65.21 110.644 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.44 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.707 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.15 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 70.11 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 71.43 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.4 ' HA3' ' CZ ' ' A' ' 26' ' ' TYR . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.11 111.807 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 71.01 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.34 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.45 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 63.12 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 72.23 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 63.54 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 53.23 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.01 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 65.1 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 65.12 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.42 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 1.016 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 55.14 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.529 ' O ' HG23 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.05 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 73.04 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 1.016 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.14 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.24 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.899 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 54.52 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 70.42 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 70.51 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.32 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.559 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 72.42 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 71.54 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.14 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.899 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.51 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.54 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 45.21 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 53.5 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 52.4 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.583 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 60.33 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.33 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 51.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.42 HG11 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 55.23 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.14 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.52 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.486 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 65.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.486 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.03 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.11 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.54 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 21.2 109.121 173.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.14 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.14 110.804 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 74.43 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 64.33 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.13 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 72.25 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 70.32 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.597 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.44 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.583 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 50.54 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.641 ' HB ' HD13 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.42 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.637 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.55 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 62.04 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 65.45 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.604 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 62.25 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.31 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 72.1 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.53 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.51 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.02 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.01 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.51 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.812 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.22 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 72.42 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.24 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.23 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.74 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.11 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 73.33 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 34.02 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 65.23 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.12 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 71.22 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.537 HH11 ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.14 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.537 ' HB2' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 64.33 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 62.33 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.748 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.03 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.402 ' HB3' HG21 ' A' ' 7' ' ' VAL . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.34 112.229 -174.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 60.54 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.42 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.748 HD12 ' HA ' ' A' ' 118' ' ' LYS . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 64.53 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 63.14 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 44.25 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 43.34 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 16.1 tm0? -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 62.5 110.444 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.676 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 62.4 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.31 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 63.43 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 60.11 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 71.4 112.048 -175.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.572 ' HB3' HG11 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 54.23 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.13 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.04 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.458 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.407 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 64.41 112.241 -176.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.584 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 54.54 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 71.31 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 61.23 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.23 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.33 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 72.35 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.506 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.31 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 63.13 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 61.42 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HA ' HD21 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 52.1 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 73.22 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ILE . . . . . 0.457 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.42 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.2 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.14 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.02 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 54.4 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.12 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.21 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.45 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.45 113.069 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 61.4 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.75 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.23 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.23 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.45 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.23 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.34 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 63.22 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.23 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.12 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.52 ' N ' HD12 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 64.12 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.21 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 72.1 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.3 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.53 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.43 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.11 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 70.02 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.774 HD11 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 64.54 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.42 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.75 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.629 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 72.41 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.11 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.513 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 63.22 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.31 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.01 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.466 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.22 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.4 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.3 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 73.33 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.491 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.24 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.774 HG22 HD11 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 53.11 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.629 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 52.44 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 73.15 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 53.43 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.446 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 62.05 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.22 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.22 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 45.14 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 65.21 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.23 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.54 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.32 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 54.21 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 71.23 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.24 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.51 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 73.33 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.509 ' O ' HG23 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.13 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.11 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.1 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 64.34 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.04 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 71.02 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.21 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 51.43 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.23 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.599 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 52.34 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.663 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 54.23 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.599 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.12 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.742 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.51 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 22.12 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 54.43 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.53 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.34 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 61.43 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 63.31 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.582 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.15 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 53.21 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.813 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 60.21 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.13 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.428 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 64.31 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.428 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 21.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 62.53 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 70.51 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.21 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 62.13 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.44 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.35 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.813 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.43 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.14 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 62.52 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.598 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.11 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.55 HG13 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.43 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' HD13 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.34 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 70.13 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 74.11 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 64.23 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 64.14 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 53.04 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.588 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 62.24 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 52.42 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.23 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 64.23 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.43 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.489 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 64.31 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.583 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.35 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.663 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.23 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 71.54 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.51 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 63.14 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 71.44 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.625 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.13 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.547 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.53 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.531 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 71.21 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 54.13 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.403 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.11 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.23 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.605 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 74.02 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 65.03 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 74.24 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.42 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 73.14 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.44 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.727 ' HA ' HD23 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 72.42 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.12 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 63.33 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.3 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.43 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 62.32 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.55 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.03 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 41.32 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.588 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.04 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.14 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 53.41 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.3 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.15 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.22 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.581 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 72.32 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 70.41 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.3 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 70.21 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.43 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.53 HD13 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.3 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.535 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.34 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 64.1 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.502 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 64.4 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 65.44 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 71.2 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.836 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.44 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 52.41 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.1 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 64.4 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.54 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.24 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.458 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.42 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 71.02 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.52 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.11 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.4 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 71.41 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.608 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 70.02 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.815 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.43 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.52 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.652 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 55.13 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 53.25 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.42 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 71.12 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.4 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.44 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.51 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.743 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.53 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.681 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.21 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 70.3 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 71.22 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.35 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.966 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 71.31 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.485 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.33 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.966 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.44 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.961 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 64.3 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.52 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.961 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.02 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.542 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 62.22 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.658 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.43 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.474 HD13 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.55 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 54.13 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 73.33 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.859 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.32 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 28' ' ' ILE . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 70.52 110.743 -173.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.45 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.675 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.24 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.04 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 64.23 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.21 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.53 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.3 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.583 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 71.14 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.21 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 70.35 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.675 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 71.32 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.34 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.11 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.675 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.42 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.32 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 74.34 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.14 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 65.51 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 73.12 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.11 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.21 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 65.42 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.52 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.44 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.551 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 64.4 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.616 ' HB3' HG23 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.11 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.716 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.32 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.12 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 44.13 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.681 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 72.12 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.702 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.44 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.33 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.413 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.31 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.44 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 62.25 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 72.11 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 79' ' ' GLN . 8.1 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.23 110.136 178.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 72.24 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 62.22 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.54 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 61.44 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.32 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.33 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.35 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.4 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 72.52 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.532 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.02 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.413 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.21 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.02 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.702 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 64.14 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 63.0 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.527 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.35 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.35 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.23 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.55 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 21.3 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.578 ' HG2' ' HB2' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 72.51 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.11 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.05 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.501 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 53.33 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.554 ' H ' ' HD3' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.24 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.22 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.43 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.42 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 73.33 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.1 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 71.33 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.522 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 62.03 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.52 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.836 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.44 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.55 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 72.44 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 52.45 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.2 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 72.14 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 63.52 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.662 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.05 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 72.4 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.516 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.44 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 51.01 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.402 ' CE2' HG22 ' A' ' 129' ' ' VAL . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 44.1 110.619 -174.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.527 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.32 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 127' ' ' PHE . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 53.2 110.514 -175.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 74.2 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.471 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 53.43 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.43 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.01 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 65.45 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.3 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 54.23 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 53.33 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.54 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.35 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.33 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . 0.655 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 40.03 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 60.33 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.442 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.24 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 71.34 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.04 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 71.12 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.453 ' N ' HD12 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 52.05 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 24.32 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 62.12 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 71.3 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.04 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 70.22 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.666 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.54 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 53.13 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.31 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.35 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.667 HG21 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.34 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 73.13 111.388 -176.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.12 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 52.13 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 72.51 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.34 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.11 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 61.11 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.429 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 71.53 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.588 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 71.32 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.34 110.849 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 70.03 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.815 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.53 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 64.5 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.31 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.44 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.13 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 71.23 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.815 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.31 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 1.052 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.04 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.422 ' HB3' HG23 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.04 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.05 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.435 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.33 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.769 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 72.21 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.917 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 71.51 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 72.35 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.786 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 63.42 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.888 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.1 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.41 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 72.25 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.43 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.888 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 44.01 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.737 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 61.12 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 54.21 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 HG13 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 70.45 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.679 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 63.23 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 63.35 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG13 HG11 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 70.31 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.3 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.43 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 1.052 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.21 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 60.35 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 44.0 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.42 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.402 ' O ' ' HB3' ' A' ' 53' ' ' PHE . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.53 110.478 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 44.3 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 63.4 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 62.12 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 53.52 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.43 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.24 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.52 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.41 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.05 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.22 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.33 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 62.43 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.31 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.12 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 73.03 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.46 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.05 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 65.43 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.917 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 72.04 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.769 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.1 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 64.34 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.34 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.422 HG23 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 61.31 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 71.15 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 64.5 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.861 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.02 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 72.34 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.13 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 74.33 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.671 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.43 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.671 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.44 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 61.03 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.4 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 51.01 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.14 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 71.32 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 53.4 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.52 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 64.53 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.861 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.34 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 71.51 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.44 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.53 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.649 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 63.13 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 72.31 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 74.54 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.11 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 71.23 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.1 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.24 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 62.44 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.659 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.43 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.21 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.32 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 70.22 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.51 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 70.03 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.425 ' O ' HG23 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 61.2 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 62.31 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.666 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.3 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG21 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 60.1 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.01 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.441 ' HD3' ' C ' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 64.54 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.21 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.737 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 64.11 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.492 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 74.52 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 53.25 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 44.13 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.42 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.51 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.03 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.413 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.24 112.37 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.34 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 51.32 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 74.51 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.649 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 73.25 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 71.12 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.31 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 51.5 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.21 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.44 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 72.42 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . 0.598 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.11 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.691 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 62.14 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.847 HD13 ' H ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.33 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 61.0 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.11 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 62.5 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 63.52 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.403 HG12 HD23 ' A' ' 146' ' ' LEU . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 74.23 112.302 -171.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.4 111.208 -175.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.31 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.403 HD23 HG12 ' A' ' 142' ' ' VAL . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.1 110.682 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 65.45 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.23 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.526 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.22 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 61.21 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.43 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . 0.543 ' OXT' HD12 ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 74.2 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.649 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 54.32 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.32 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 71.22 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 45.54 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.14 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 74.41 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.02 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 70.13 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 72.42 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.35 110.047 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.44 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.44 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 63.45 109.618 175.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.33 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.455 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 71.14 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.12 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.12 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 71.31 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 71.03 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 72.2 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.02 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.32 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 72.11 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.686 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.04 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 72.4 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' VAL . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 62.22 109.236 171.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.44 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.668 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.91 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.23 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 63.0 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.13 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.24 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 71.22 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.567 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 71.5 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.52 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.12 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.434 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 71.21 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.24 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.406 HG22 HD11 ' A' ' 27' ' ' ILE . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.14 110.501 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.91 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.3 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 71.21 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 27' ' ' ILE . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.4 109.384 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.34 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.686 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 71.32 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 74.03 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 55.33 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 71.31 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' O ' HG23 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 64.44 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.33 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.14 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.681 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 53.11 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 45.24 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 64.43 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.869 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 73.43 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.478 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 64.45 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.05 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 71.35 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.59 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 65.04 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.517 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 61.35 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.41 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 53.04 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 44.34 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.623 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 65.34 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.15 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.412 ' H ' ' NH2' ' A' ' 106' ' ' ARG . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 55.22 108.414 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.59 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 63.22 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.668 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 72.25 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.681 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 72.31 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 61.13 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.32 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.574 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.44 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.24 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.826 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 55.31 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.31 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.35 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.32 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 54.24 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 72.23 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 73.55 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.15 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.77 ' HB3' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.01 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 52.25 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.34 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.52 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.77 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 60.41 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.616 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 63.11 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 72.13 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.42 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 91' ' ' LYS . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 70.34 110.483 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 71.02 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 72.45 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 128' ' ' GLN . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 74.52 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.2 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.12 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 63.12 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.2 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.422 ' HD2' ' O ' ' A' ' 66' ' ' GLU . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 53.23 112.125 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.43 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.21 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.31 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.579 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.51 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.451 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.24 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 73.5 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.412 ' NH2' ' H ' ' A' ' 67' ' ' CYS . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.33 111.077 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.688 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.34 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.31 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.21 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.688 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.41 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.649 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 62.31 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.406 ' HA ' ' C ' ' A' ' 1' ' ' MET . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 54.55 111.361 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.1 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.11 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 62.32 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.53 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.61 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.41 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.541 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.11 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 64.05 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.532 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.11 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.13 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 64.33 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.716 ' HA ' HD23 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 50.55 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 73.23 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 70.32 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.716 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 74.42 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.35 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.615 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 71.22 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 51.25 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 130' ' ' GLN . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.45 111.36 -177.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.11 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 62.31 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.4 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.53 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 73.03 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.41 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.11 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 63.23 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 73.32 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 65.3 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.14 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.409 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 74.34 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.54 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.14 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.4 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 74.33 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 63.45 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 72.23 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.4 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.607 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.43 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . 0.417 ' OXT' HD12 ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 55.35 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.4 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.41 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.53 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 44.31 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.15 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.12 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.32 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 51.53 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.32 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.415 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 72.24 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.632 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 61.41 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.526 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 63.34 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 42.53 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 65.44 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.667 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.743 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 33.23 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 72.52 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 73.31 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.743 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.4 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.24 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.4 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.53 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.05 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.23 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 71.14 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 74.31 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.501 HD11 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.42 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.526 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.33 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.23 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 63.21 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 53.21 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.699 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.03 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.12 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.44 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.33 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.33 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 71.12 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.23 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.632 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 50.0 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG13 HD11 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 64.3 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 72.14 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.42 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 51.3 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.04 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 63.41 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.52 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.42 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 52.43 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.472 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 60.45 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 71.25 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.12 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 63.54 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 61.31 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.43 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.03 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.416 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 74.24 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 72.21 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 64.22 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 74.43 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 64.22 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.481 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.43 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.44 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.43 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.32 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 63.22 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.53 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.11 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.684 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.24 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 73.14 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.13 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.73 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.21 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 60.33 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.781 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 61.11 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.54 HG11 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 62.2 110.67 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 63.33 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 62.32 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 80' ' ' ARG . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 71.22 110.517 -175.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 63.34 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.33 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.42 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 51.11 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 71.34 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.53 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.539 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 62.12 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.581 HG22 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 73.31 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.535 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.781 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.12 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.51 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.73 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.52 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.706 HD11 HG23 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 64.14 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.684 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 71.24 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 73.22 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.532 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 65.32 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.21 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.3 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.02 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.493 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.05 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.478 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 64.41 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.34 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.44 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 74.42 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.43 110.399 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 63.14 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 71.33 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.407 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.33 110.688 175.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.4 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.12 110.954 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.52 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.44 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.476 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 32.03 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.52 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.12 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.524 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.12 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.43 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 64.24 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 52.34 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.526 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 74.34 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.23 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.752 ' HA ' HD23 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.45 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.51 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 62.23 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 63.04 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.496 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.14 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.51 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.706 HG23 HD11 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.44 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.513 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 72.5 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 74.22 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.22 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 70.23 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . 0.413 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.14 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.419 ' HB2' ' OE2' ' A' ' 133' ' ' GLU . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.32 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.03 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.22 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 65.22 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.45 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.488 HG22 HG11 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 61.22 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.31 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.13 111.479 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.13 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.54 ' HG3' HG11 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.24 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.53 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 53.5 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.13 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 70.35 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.703 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 70.41 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 72.21 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 53.11 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 54.22 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.769 HG13 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.55 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 61.55 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.59 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.02 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.14 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 64.32 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.1 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.13 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.14 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 41.11 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 51.31 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.43 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.22 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.53 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.1 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.4 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.31 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.15 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.35 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.657 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.42 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.34 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.541 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 62.2 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.589 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 64.41 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.14 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.05 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.485 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 55.4 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.04 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.15 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.02 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.52 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.808 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 72.31 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 73.21 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.808 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 71.25 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.769 ' HB ' HG13 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.02 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.52 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.597 HD13 HD23 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.14 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 54.45 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.03 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.42 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 65.34 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.479 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.21 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.42 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.628 ' HD3' ' H ' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 63.4 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 70.41 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.49 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 53.43 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.21 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.444 ' O ' HG23 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 64.32 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 74.51 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 52.33 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 72.03 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.32 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.23 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.31 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.406 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.32 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.51 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 64.03 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.23 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 63.13 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.13 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.35 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.4 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.4 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 44.24 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.02 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.485 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 64.31 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.51 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.04 112.083 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 52.45 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.52 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.449 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.55 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 51.14 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.808 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 64.42 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 64.44 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' SER . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 73.23 111.328 -175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.438 ' HB ' ' HG2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 73.4 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' H ' HG12 ' A' ' 78' ' ' VAL . 33.3 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 70.11 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.43 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.52 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 55.3 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.14 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.01 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.21 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 77' ' ' THR . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.45 109.748 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 55.43 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 73.44 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.808 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.42 110.284 176.354 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.559 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 64.42 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.34 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.461 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 64.42 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.64 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 65.24 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 54.31 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.484 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 73.4 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.44 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.11 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.12 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.13 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.21 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.54 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.44 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.41 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 65.32 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.3 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 65.43 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.563 ' HB3' HD13 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.23 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 96' ' ' GLN . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.02 110.559 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.703 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.43 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.41 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.34 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.54 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.23 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.42 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.597 HD23 HD13 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.12 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.02 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.3 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 65.11 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.589 HD22 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.05 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 54.05 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.12 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.34 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 65.24 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.32 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.51 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.64 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.44 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.33 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.53 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.2 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 51.55 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.52 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.41 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 62.44 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 72.34 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 73.44 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 63.54 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 53.33 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.517 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.35 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 73.14 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 43.03 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 54.12 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.517 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 61.22 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.14 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.24 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 71.21 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.31 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 64.23 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.34 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.559 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 54.31 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.617 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 73.23 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 54.15 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.592 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.23 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.32 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 71.4 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 45.13 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.32 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.21 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 71.35 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 73.22 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 70.44 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.51 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.528 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.52 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.23 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 63.1 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.643 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 73.42 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 72.11 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.54 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.833 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 73.42 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.41 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 61.2 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 73.53 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.56 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 62.0 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 71.53 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.833 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.13 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.01 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.651 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.11 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.61 HD11 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 72.23 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.42 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.534 ' HB3' HG22 ' A' ' 38' ' ' ILE . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.11 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.636 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 62.11 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 62.33 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.24 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 70.11 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.22 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.52 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.31 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.497 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 43.51 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.786 HD13 HD23 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.14 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.24 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.61 HG22 HD11 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.35 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 70.15 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.817 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 55.34 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.34 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 20.12 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.437 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 61.12 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.13 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.04 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 70.32 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.25 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 61.3 110.814 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 73.01 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.24 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 61.1 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.32 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.817 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.32 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.3 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.41 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.52 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 44.23 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.03 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.15 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.22 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 60.21 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 62.31 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.03 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 62.43 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 71.12 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.42 108.661 175.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 51.13 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 51.44 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.624 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.24 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.844 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.21 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.13 109.706 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.43 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.481 ' HB ' HE22 ' A' ' 150' ' ' GLN . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.34 109.719 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 62.52 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 63.23 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.05 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 63.24 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.04 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.1 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 60.33 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.1 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.514 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.22 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.11 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.21 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 62.03 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.11 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.619 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.53 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.501 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 64.44 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.12 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.669 HD11 HG23 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 72.35 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.34 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 55.35 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.43 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.52 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 73.23 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 61.04 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.43 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 50.21 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.685 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 62.04 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 54.22 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.32 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.685 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 73.13 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 73.15 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.1 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.33 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.24 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.24 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.13 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.41 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 115' ' ' ARG . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.53 111.05 -176.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.23 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.786 HD23 HD13 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.02 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.59 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 61.4 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 45.0 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 44.54 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 64.53 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.55 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.41 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.576 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.35 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.03 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 71.11 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.44 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 71.14 110.188 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.669 HG23 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 71.24 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.03 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.41 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.22 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 70.12 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.495 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.12 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.11 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.532 ' HB2' ' HB1' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.42 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.22 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . 0.542 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.12 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 73.44 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.04 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 61.21 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 61.13 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.467 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.23 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 65.43 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.15 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.32 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.42 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 64.23 109.38 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.15 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.44 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.501 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 47.5 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.3 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 72.31 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.34 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.863 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.32 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.41 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 52.22 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 72.23 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.532 HG13 HG22 ' A' ' 36' ' ' THR . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 71.12 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.24 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 71.44 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.24 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 71.45 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.24 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 71.51 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.33 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 51.12 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.03 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.54 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 53.13 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 71.15 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 63.11 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 64.43 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 71.23 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.03 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 64.12 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 52.21 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.03 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 60.23 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 72.54 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 43.15 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 64.01 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 64.04 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.604 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 70.3 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.725 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.32 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.42 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.43 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.31 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.532 HG22 HG13 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.24 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 63.0 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 63.22 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.544 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 64.22 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.4 HG22 HD11 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 62.23 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 62.11 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 72.24 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.446 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.14 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.12 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.55 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.23 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 73.21 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.3 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.43 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 71.54 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.23 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.53 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.01 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' HE2' ' HH ' ' A' ' 97' ' ' TYR . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 73.42 110.388 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 64.22 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.566 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.13 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.35 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.491 ' HA ' HH22 ' A' ' 68' ' ' ARG . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.01 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 73.15 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.4 HD23 ' CZ ' ' A' ' 68' ' ' ARG . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 74.42 111.661 -177.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 45.33 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.41 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 53.43 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 54.13 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.33 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 73.25 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.11 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.34 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.13 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB2' HG23 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 53.22 110.499 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.15 109.608 176.121 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.22 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 62.41 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG22 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 60.42 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.668 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 70.03 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.415 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 70.33 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 64.04 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 65.24 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.03 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 33.04 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 64.32 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.21 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.668 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.43 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.34 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.403 HG22 ' HB ' ' A' ' 77' ' ' THR . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.416 177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.14 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.63 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.45 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 71.15 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.22 110.534 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.538 ' HB ' HD13 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.12 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.416 ' HD1' ' HB2' ' A' ' 71' ' ' ALA . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.43 109.416 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 52.43 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.914 HE22 HG22 ' A' ' 114' ' ' VAL . 84.4 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 61.35 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.32 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 62.3 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.22 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 71.44 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.31 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 43.41 111.303 -177.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.15 111.754 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.3 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.656 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 72.44 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 70.23 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.563 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 53.33 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 53.44 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.23 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.05 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.863 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.34 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 62.15 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.914 HG22 HE22 ' A' ' 96' ' ' GLN . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.33 111.7 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 52.4 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 52.14 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 72.02 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 73.33 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 52.11 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.453 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 73.21 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 63.24 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.51 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.798 ' HA ' HD23 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 63.12 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 65.12 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 45.3 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.798 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.11 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 71.45 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.1 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.41 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 65.22 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 54.31 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.461 ' CB ' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 70.24 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.02 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 55.23 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . 0.459 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 51.25 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.14 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 62.44 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.22 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.12 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.01 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 70.02 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.31 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 72.05 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.21 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.31 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 51.52 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.533 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 42.24 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.14 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.14 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.533 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.24 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 151' ' ' ARG . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 72.1 111.535 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 71.05 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.967 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 72.45 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.24 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.05 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.22 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.492 HG12 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.03 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.611 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.21 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 53.25 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 60.44 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 63.42 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 44.42 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.479 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.52 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 61.12 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.408 HD22 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.21 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.52 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.678 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.12 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 55.1 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.21 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.23 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 71.13 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 50.42 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.42 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 65.52 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.43 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.05 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.12 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HE1' ' HB1' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.3 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 61.33 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.04 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HE1' HD22 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.31 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.31 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.55 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.34 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.32 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.05 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.463 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.14 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.1 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.43 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.531 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.35 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.13 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.43 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 64.23 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.01 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 40.13 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 62.54 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 71.23 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 64.03 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 42.12 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.44 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.636 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.1 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.41 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.31 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 70.3 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 64.4 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.41 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 65.32 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.58 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 52.21 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.57 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 42.03 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.23 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 72.43 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 63.14 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 63.42 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 52.51 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 64.54 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.51 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.451 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 50.15 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.548 ' N ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.31 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.3 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.54 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.53 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.3 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.861 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.34 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 43.21 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.31 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.41 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.24 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 43.34 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.632 ' H ' HG12 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.45 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.791 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.33 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.03 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.32 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.02 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.44 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.11 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.22 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 65.41 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.35 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.519 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.23 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.745 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.41 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.861 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.03 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.483 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 63.21 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 61.35 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 60.42 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.23 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.12 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.2 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.539 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 64.32 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.11 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 74.11 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 71.34 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 64.43 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.35 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.14 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.3 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 62.33 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 73.22 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 54.13 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.14 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 71.13 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.967 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.12 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.591 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 50.23 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 35.23 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.53 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.21 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 52.55 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.827 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 64.25 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.54 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.34 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.44 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.34 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.827 HD12 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 55.44 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.24 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.51 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 64.43 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 72.22 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.54 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 64.11 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.1 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 71.31 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.11 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 64.44 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.34 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 64.14 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.43 110.82 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.543 ' O ' HD13 ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.43 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.35 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.21 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.4 111.616 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.4 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.662 HG12 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.11 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 53.1 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.54 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.43 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.662 HD23 HG12 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.24 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.453 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 54.22 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . 0.791 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.23 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.44 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.45 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 72.31 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 54.41 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 62.24 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.24 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 51.22 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 41.23 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 63.41 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.34 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 120' ' ' SER . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 63.13 109.46 171.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.11 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.01 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.04 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HA ' HG23 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.13 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 64.45 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.32 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 43.32 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.542 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 64.02 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 73.2 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.12 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.35 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.477 ' HD2' HG21 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.4 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.4 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.63 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 71.14 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.436 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.23 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.527 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 72.53 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 62.32 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.14 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.34 110.762 -177.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.12 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.05 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.707 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 63.15 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.74 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.34 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.446 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 72.34 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.709 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 72.32 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.44 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.709 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.15 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.2 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 53.3 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.456 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 63.13 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 65.21 110.644 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.44 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.707 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.15 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 70.11 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 71.43 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.4 ' HA3' ' CZ ' ' A' ' 26' ' ' TYR . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.11 111.807 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 71.01 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.34 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.45 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 63.12 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 72.23 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 63.54 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 53.23 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.01 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 65.1 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 65.12 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.42 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 1.016 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 55.14 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.529 ' O ' HG23 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.05 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 73.04 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 1.016 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.14 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.24 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.899 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 54.52 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 70.42 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 70.51 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.32 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.559 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 72.42 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 71.54 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.14 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.899 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.51 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.54 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 45.21 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 53.5 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 52.4 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.583 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 60.33 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.33 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 51.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.42 HG11 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 55.23 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.14 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.52 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.486 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 65.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.486 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.03 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.11 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.54 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 21.2 109.121 173.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.14 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.14 110.804 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 74.43 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 64.33 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.13 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 72.25 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 70.32 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.597 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.44 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.583 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 50.54 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.641 ' HB ' HD13 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.42 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.637 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.55 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 62.04 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 65.45 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.604 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 62.25 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.31 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 72.1 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.53 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.51 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.02 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.01 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.51 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.812 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.22 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 72.42 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.24 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.23 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.74 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.11 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 73.33 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 34.02 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 65.23 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.12 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 71.22 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.537 HH11 ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.14 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.537 ' HB2' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 64.33 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 62.33 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.748 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.03 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.402 ' HB3' HG21 ' A' ' 7' ' ' VAL . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.34 112.229 -174.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 60.54 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.42 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.748 HD12 ' HA ' ' A' ' 118' ' ' LYS . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 64.53 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 63.14 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 44.25 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 43.34 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.437 HE21 ' HB3' ' A' ' 128' ' ' GLN . 0.9 OUTLIER -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 62.5 110.444 176.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.676 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 62.4 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.31 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 63.43 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 60.11 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 71.4 112.048 -175.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.572 ' HB3' HG11 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 54.23 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.13 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.04 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . 0.458 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.407 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 64.41 112.241 -176.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.584 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 54.54 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 71.31 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 61.23 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.23 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.33 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 72.35 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.506 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.31 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 63.13 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 61.42 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HA ' HD21 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 52.1 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 73.22 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ILE . . . . . 0.457 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 86.3 mtp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.632 0.253 . . . . 64.42 111.013 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.24 130.91 16.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.637 -0.256 . . . . 53.2 110.702 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.0 t -158.26 -171.32 3.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.575 -0.528 . . . . 64.14 109.575 178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.49 62.5 4.09 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.15 -0.548 . . . . 72.02 112.932 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.88 126.52 41.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.406 -0.59 . . . . 54.4 109.406 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 tptt -76.22 131.64 39.43 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.837 0.351 . . . . 71.12 111.166 -173.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.6 m -97.64 127.89 49.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.116 0.484 . . . . 74.21 110.456 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 3.5 t70 -85.31 136.62 37.57 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.932 -0.576 . . . . 44.45 111.222 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 16.0 Cg_exo -68.84 -31.01 25.94 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 122.97 2.447 . . . . 72.45 113.069 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.4 m -65.89 -46.83 76.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.688 0.28 . . . . 61.4 111.338 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.75 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 12.7 p -69.39 -31.24 69.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.796 0.331 . . . . 75.23 110.898 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -68.92 -39.8 79.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 75.23 110.177 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.512 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 48.3 t30 -59.67 -39.5 84.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.456 -0.572 . . . . 62.45 109.456 174.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.9 -32.71 74.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.463 -0.79 . . . . 71.23 110.915 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -57.96 -52.14 66.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.32 -0.4 . . . . 74.34 110.418 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.42 -36.33 83.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 63.22 110.216 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 86.4 mt -62.55 -40.48 96.96 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.694 -0.685 . . . . 75.23 111.544 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.52 HD12 ' N ' ' A' ' 19' ' ' HIS . 4.1 pp -83.52 -41.23 18.19 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.037 0.384 . . . . 73.12 112.037 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.52 ' N ' HD12 ' A' ' 18' ' ' LEU . 73.4 t60 -74.74 -44.18 51.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.993 0.368 . . . . 64.12 111.993 -172.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.13 -42.32 5.33 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.919 -0.313 . . . . 72.21 111.733 -175.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -86.9 -12.47 47.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.503 -0.317 . . . . 72.1 110.545 -175.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.7 p80 42.59 45.12 3.88 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 124.29 0.994 . . . . 75.3 111.867 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -77.62 -34.6 53.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.473 -0.785 . . . . 75.53 109.453 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 45' ' ' GLU . 23.0 m80 -128.9 169.97 13.98 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.024 -0.989 . . . . 74.43 109.768 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 p -105.46 -61.63 1.46 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.095 0.474 . . . . 74.11 110.628 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CE2' ' HA3' ' A' ' 44' ' ' GLY . 37.8 p90 -121.37 157.48 30.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 70.02 110.665 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.774 HD11 HG22 ' A' ' 40' ' ' VAL . 9.7 tt -142.05 129.8 20.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.621 -0.718 . . . . 64.54 109.9 170.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' LYS . 50.7 mt -94.78 142.61 13.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.883 -0.599 . . . . 75.42 109.756 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.75 ' HE1' ' HB2' ' A' ' 11' ' ' CYS . 65.0 m-85 -118.99 148.59 42.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.548 0.213 . . . . 75.25 110.591 -178.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.629 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -147.22 161.41 40.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.386 -0.37 . . . . 72.41 110.222 171.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 31' ' ' ILE . 4.2 mp -82.26 118.23 29.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.86 -0.422 . . . . 75.11 109.86 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.513 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 25.7 t0 -107.37 155.0 20.48 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.923 -0.581 . . . . 63.22 110.287 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 18.0 ptpt 57.07 163.32 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.193 1.397 . . . . 75.31 112.852 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -76.82 -19.42 57.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.858 -0.61 . . . . 73.01 110.489 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.466 ' HB3' ' CD ' ' A' ' 33' ' ' LYS . 28.3 t70 -78.05 3.46 14.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.9 -0.591 . . . . 75.22 110.232 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.5 p 55.3 92.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.328 1.051 . . . . 61.4 113.37 175.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -128.29 129.1 45.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.571 -0.74 . . . . 74.3 110.353 174.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.457 ' O ' ' HB3' ' A' ' 8' ' ' ASP . 41.4 mt -75.34 120.97 26.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 108.561 -0.903 . . . . 73.33 108.561 175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.491 HG22 ' H ' ' A' ' 40' ' ' VAL . 4.1 p -141.06 168.67 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.774 -0.37 . . . . 74.24 110.799 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.774 HG22 HD11 ' A' ' 27' ' ' ILE . 46.9 t -60.21 131.95 25.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.715 -0.675 . . . . 53.11 111.691 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.629 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 4.0 tp10 -101.64 -46.45 4.95 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.578 -0.737 . . . . 52.44 109.195 170.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.5 tptp -157.73 127.78 6.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.639 -0.71 . . . . 73.15 110.433 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.2 m -102.08 150.52 6.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.526 -0.546 . . . . 53.43 109.526 171.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 26' ' ' TYR . . . -124.3 136.2 10.01 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.776 -0.726 . . . . 60.5 111.471 176.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.446 ' HA ' ' HD2' ' A' ' 24' ' ' HIS . 13.7 mm-40 -58.49 161.79 4.26 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.281 -0.266 . . . . 62.05 110.281 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 46' ' ' LYS . 8.5 tmtt? -53.27 -47.99 68.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.74 0.305 . . . . 73.22 110.631 -174.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.23 91.99 8.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.07 0.462 . . . . 75.22 110.259 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -128.63 108.14 18.82 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.957 -0.565 . . . . 45.14 110.677 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.55 147.94 84.02 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.582 2.188 . . . . 65.21 111.58 176.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -60.3 -31.5 70.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.23 110.275 -178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.72 -48.82 80.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.762 -0.654 . . . . 72.54 111.121 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -65.56 -33.62 76.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 116.442 -0.344 . . . . 75.32 111.294 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -57.09 -44.65 83.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.1 0.476 . . . . 54.21 110.208 176.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.1 t -68.64 -46.23 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 71.23 110.467 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -55.43 -53.38 56.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 71.24 112.21 -178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.51 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 9.4 mm-40 -62.66 -38.29 89.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.973 -0.558 . . . . 73.33 111.682 -175.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.509 ' O ' HG23 ' A' ' 61' ' ' VAL . 55.6 ttp -77.92 -37.57 47.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.724 0.297 . . . . 74.13 110.858 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.9 tmmm? -51.12 -48.25 61.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.906 -0.588 . . . . 74.11 111.822 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 57.1 pttt -68.08 -30.66 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.709 0.633 . . . . 71.1 112.709 -172.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 57' ' ' MET . 4.5 pp -85.66 -13.72 47.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.46 -0.496 . . . . 64.34 112.111 -175.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 57' ' ' MET . 84.0 t -85.98 -27.21 6.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 112.118 0.414 . . . . 74.04 112.118 -177.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -60.82 -14.61 22.86 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.956 0.725 . . . . 71.02 112.956 -170.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.21 -30.49 71.55 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.654 0.264 . . . . 73.21 111.628 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.34 -159.45 22.93 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.4 -0.905 . . . . 51.43 111.857 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -86.81 76.78 9.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.847 0.832 . . . . 75.23 109.349 175.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.599 ' HB3' ' NH1' ' A' ' 68' ' ' ARG . 27.1 mm-40 -89.55 143.4 26.84 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.515 -1.22 . . . . 52.34 111.344 -173.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.663 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 27.9 p -109.82 127.59 54.77 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.526 -0.546 . . . . 54.23 109.526 174.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.599 ' NH1' ' HB3' ' A' ' 66' ' ' GLU . 8.8 mpt_? -131.97 139.31 48.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.714 0.292 . . . . 74.12 110.516 -177.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.742 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 56.1 m-85 -95.05 141.84 28.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.425 -0.583 . . . . 75.51 109.425 177.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.81 122.96 26.61 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.426 -0.51 . . . . 22.12 111.476 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -117.49 117.61 29.93 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.721 -0.672 . . . . 54.43 109.298 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 5.4 p -126.17 127.65 71.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-O 120.963 0.411 . . . . 71.53 111.234 -177.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -96.12 94.43 7.53 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.34 109.215 177.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.66 136.05 58.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.758 -0.656 . . . . 61.43 110.813 -174.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -93.53 106.94 18.86 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.573 0.702 . . . . 63.31 110.312 178.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.582 ' HB ' ' OE1' ' A' ' 150' ' ' GLN . 14.1 t -100.04 154.29 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.134 -1.061 . . . . 74.15 108.134 174.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -116.84 143.71 45.36 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.264 -0.574 . . . . 53.21 111.5 -174.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.813 HG23 ' HB3' ' A' ' 87' ' ' SER . 2.9 m -126.22 -174.56 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.295 -0.866 . . . . 60.21 109.752 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -110.78 103.92 12.5 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.799 -0.815 . . . . 74.13 108.799 170.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.428 ' HB3' ' H ' ' A' ' 81' ' ' GLN . 22.5 mmt180 -156.87 -151.13 0.31 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 64.31 110.411 -172.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.428 ' H ' ' HB3' ' A' ' 80' ' ' ARG . 21.5 mt-30 -66.92 162.07 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.759 -0.655 . . . . 62.53 111.159 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.87 -63.82 0.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 111.015 -0.834 . . . . 70.51 111.015 -178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 137.41 22.53 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.388 -0.597 . . . . 64.21 109.388 176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -72.34 81.52 1.03 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.748 0.785 . . . . 62.13 111.314 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.75 -57.04 0.36 Allowed Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 115.527 -0.76 . . . . 73.44 111.806 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.1 p -128.43 107.69 9.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.642 0.734 . . . . 74.35 112.054 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.813 ' HB3' HG23 ' A' ' 78' ' ' VAL . 14.1 t -104.04 104.42 14.37 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.914 -1.143 . . . . 74.43 107.914 172.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' ' 75' ' ' GLU . 2.6 m -108.67 121.42 45.0 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.985 0.421 . . . . 72.14 111.315 -172.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.8 mp -131.5 128.25 38.99 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.692 -0.686 . . . . 62.52 109.478 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.598 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 23.4 p-10 -78.4 108.99 12.16 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.599 0.714 . . . . 75.11 109.876 175.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -110.07 103.89 12.69 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.355 -0.609 . . . . 70.0 109.355 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.55 HG13 ' HG ' ' A' ' 126' ' ' LEU . 3.7 p -67.61 108.46 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.535 0.683 . . . . 75.43 110.043 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' HD13 ' A' ' 146' ' ' LEU . 14.1 tt -101.92 140.44 20.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 115.543 -0.753 . . . . 70.34 110.372 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 81.9 t80 -104.43 107.71 18.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 116.137 -0.483 . . . . 70.13 109.944 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.4 t -112.19 107.31 22.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.137 -0.483 . . . . 74.11 109.955 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -84.34 123.85 30.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.129 -0.487 . . . . 64.23 110.526 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -100.68 109.88 21.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.025 -0.534 . . . . 64.14 110.392 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 41.9 t -162.55 117.58 1.2 Allowed Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.075 -0.512 . . . . 53.04 110.972 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.588 ' HA ' ' HB3' ' A' ' 132' ' ' SER . 39.1 Cg_endo -71.82 156.31 56.99 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.114 1.876 . . . . 62.24 110.447 170.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.21 -24.3 61.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.149 0.5 . . . . 52.42 110.623 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -75.08 4.26 7.07 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.648 -0.706 . . . . 75.23 111.966 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 148.08 90.15 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 110.376 -0.231 . . . . 64.23 110.376 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.14 126.41 20.25 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.922 2.415 . . . . 75.43 112.247 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.489 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 65.7 t -54.12 -33.49 24.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.025 -0.534 . . . . 64.31 112.269 -174.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.583 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.8 mpt_? -60.58 -56.39 21.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.251 0.548 . . . . 73.35 109.538 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.663 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 36.1 ttm180 -65.24 -35.1 80.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.438 -0.801 . . . . 74.23 110.742 174.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 19.7 tpt180 -57.62 -41.71 81.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.682 -0.69 . . . . 71.54 110.96 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.8 tpt -65.98 -44.88 83.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.349 -0.387 . . . . 74.51 111.001 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.84 -43.05 99.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 63.14 109.892 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -56.49 -51.04 69.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.013 -0.994 . . . . 71.44 110.969 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.625 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.78 -35.99 82.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.075 -0.511 . . . . 55.13 111.214 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.547 ' HA ' ' C ' ' A' ' 1' ' ' MET . 20.1 m -80.53 -11.05 59.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.063 0.459 . . . . 74.53 111.203 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.531 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 47.2 t -86.6 -19.38 29.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 71.21 110.768 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 118' ' ' LYS . 84.4 t -57.47 -58.0 7.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.087 -0.506 . . . . 54.13 112.172 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.403 ' C ' ' HD3' ' A' ' 115' ' ' ARG . 3.7 tmt_? -65.04 -34.98 79.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.719 0.295 . . . . 75.11 110.506 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.0 -56.3 23.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.137 -0.483 . . . . 62.23 111.431 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.605 ' HA ' HD13 ' A' ' 121' ' ' LEU . 3.7 pp -75.1 -22.84 57.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.678 0.251 . . . . 74.02 111.678 -176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.485 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.2 OUTLIER -55.73 -57.85 10.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 65.03 110.971 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.84 -41.13 15.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.36 -0.382 . . . . 74.24 111.751 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.6 t -67.18 -27.46 67.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.357 0.503 . . . . 72.42 112.357 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 117' ' ' LEU . 10.1 mp -91.47 11.39 24.15 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.699 -0.4 . . . . 73.14 111.309 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 13.88 82.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.631 -0.795 . . . . 73.44 112.216 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.727 ' HA ' HD23 ' A' ' 126' ' ' LEU . 85.4 mt -93.19 22.24 5.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.987 0.422 . . . . 72.42 110.066 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -51.06 -55.1 19.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 74.12 112.133 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.0 m -94.64 4.27 54.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.046 0.45 . . . . 63.33 110.897 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -90.52 159.03 16.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 75.3 110.742 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -88.77 146.87 24.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 73.43 111.325 -174.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -123.31 117.86 26.21 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.336 -0.847 . . . . 62.32 109.722 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 48.6 t -114.65 148.22 17.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.974 -0.557 . . . . 75.55 109.808 -177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -111.96 138.47 48.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 72.03 110.751 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -136.15 131.49 34.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.198 -0.455 . . . . 41.32 109.791 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.588 ' HB3' ' HA ' ' A' ' 99' ' ' PRO . 16.6 m -107.53 -29.07 9.41 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.771 0.286 . . . . 75.04 111.771 -175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -120.8 156.47 31.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.786 0.327 . . . . 72.14 110.749 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -73.14 -15.6 61.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.969 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.2 m -80.19 -25.78 39.55 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.285 0.564 . . . . 53.41 110.401 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -85.44 -22.49 28.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 74.3 111.566 -174.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.4 0.51 28.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.064 0.459 . . . . 74.15 111.073 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.81 144.51 54.68 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.867 -0.606 . . . . 72.22 109.993 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.581 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -50.03 -22.85 1.75 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.698 -0.683 . . . . 72.32 112.805 -175.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.82 -35.33 4.34 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.16 0.43 . . . . 70.41 112.16 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.9 m -103.49 -56.39 2.22 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 122.365 -0.209 . . . . 73.3 110.984 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.0 t -57.12 -50.3 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.873 -173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 1.5 tmmm? -63.93 -44.98 91.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.267 -0.424 . . . . 74.21 110.119 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 m -65.16 -45.96 82.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.117 -0.492 . . . . 70.21 111.61 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.81 -46.75 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.329 -0.396 . . . . 75.43 110.913 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.53 HD13 ' HB ' ' A' ' 93' ' ' ILE . 50.5 tp -65.92 -37.99 87.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.3 111.133 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.535 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 26.8 ttt -57.23 -34.53 68.67 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.04 -0.527 . . . . 72.34 111.293 -178.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 33.2 t -73.82 -49.52 24.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 64.1 110.625 -178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.502 ' HA ' ' HB ' ' A' ' 152' ' ' ILE . 18.8 m120 -85.01 15.19 4.21 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.586 0.588 . . . . 64.4 112.586 -172.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.582 ' OE1' ' HB ' ' A' ' 76' ' ' VAL . 23.6 mt-30 -55.24 -46.01 76.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.805 0.336 . . . . 65.44 110.852 173.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.05 11.4 12.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.028 0.442 . . . . 71.2 110.901 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 149' ' ' ASN . 59.6 mt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.836 -0.602 . . . . 74.5 110.058 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.836 ' HB3' ' HB2' ' A' ' 115' ' ' ARG . 59.7 mtt . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.768 -0.456 . . . . 73.44 109.768 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.5 -161.06 0.56 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.747 0.308 . . . . 52.41 110.715 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 p -134.16 171.02 14.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.987 -0.551 . . . . 75.1 109.711 175.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.64 -30.98 3.87 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.365 -0.922 . . . . 64.4 112.327 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.7 t -71.12 134.47 29.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.359 -0.608 . . . . 72.54 109.359 177.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -72.15 133.75 45.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.367 0.603 . . . . 75.24 111.694 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.458 HG12 HD12 ' A' ' 38' ' ' ILE . 9.9 m -95.23 102.29 13.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.081 -0.963 . . . . 72.42 109.477 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.22 129.84 93.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.63 -0.714 . . . . 71.02 110.325 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.91 -24.72 66.22 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.996 2.464 . . . . 71.52 112.732 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 6.5 m -62.65 -37.39 86.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.96 0.409 . . . . 74.11 110.554 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.1 m -67.48 -36.44 81.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.587 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -76.43 -36.01 58.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.047 -0.524 . . . . 70.4 110.211 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -63.58 -34.31 77.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.75 -0.659 . . . . 71.41 110.253 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.54 -30.03 33.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.647 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.608 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 81.8 t80 -62.16 -49.99 73.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.703 . . . . 70.02 111.791 -178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.815 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 1.9 m-20 -64.33 -22.83 67.08 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.358 0.503 . . . . 74.43 112.358 -174.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 17' ' ' LEU . 34.4 mt -64.81 -39.46 93.63 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.855 -0.338 . . . . 55.52 110.673 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.652 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.4 pp -85.4 -29.35 24.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.013 0.435 . . . . 55.13 110.354 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 11.6 t-160 -61.0 -49.69 76.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.393 -0.821 . . . . 53.25 111.709 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -108.29 -64.47 1.22 Allowed 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.35 -0.54 . . . . 74.42 111.515 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.4 tmtt? -62.14 -33.59 74.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.385 -0.37 . . . . 71.12 110.35 -177.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' A' ' 21' ' ' LYS . 48.4 m80 70.56 42.68 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.474 -0.784 . . . . 72.4 110.498 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 tt0 -71.27 -39.04 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.916 -1.038 . . . . 64.44 109.938 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 81.7 m-70 -109.86 171.24 7.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.688 -0.687 . . . . 75.51 109.613 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.743 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 43.3 t -127.67 -64.05 1.0 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.683 -0.488 . . . . 73.53 109.683 174.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.681 ' HD1' ' HB ' ' A' ' 72' ' ' VAL . 88.5 t80 -103.33 131.11 50.66 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.581 -0.736 . . . . 75.21 110.443 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.7 tt -140.91 142.3 30.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.211 -0.45 . . . . 70.3 110.167 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.616 HG23 ' HB3' ' A' ' 68' ' ' ARG . 66.6 mt -109.48 136.44 45.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.006 -0.543 . . . . 71.22 111.03 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.716 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 88.5 m-85 -116.07 149.04 39.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.054 -0.521 . . . . 74.35 110.211 177.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.966 ' HD3' ' HB2' ' A' ' 32' ' ' ASP . 5.4 ptpt -148.89 147.36 28.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.781 0.324 . . . . 71.31 111.375 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.485 ' H ' HD12 ' A' ' 31' ' ' ILE . 4.5 mp -84.4 109.57 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 107.988 -1.116 . . . . 73.33 107.988 170.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.966 ' HB2' ' HD3' ' A' ' 30' ' ' LYS . 4.6 t70 -139.65 81.79 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.372 -0.531 . . . . 64.44 112.224 -171.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.961 ' HE2' ' HB3' ' A' ' 35' ' ' ASP . 16.6 ptmt 167.03 157.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.088 0.868 . . . . 64.3 109.732 175.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.49 -33.28 72.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.332 0.586 . . . . 65.52 109.548 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.961 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 8.3 t70 -61.64 -22.99 65.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.202 -0.908 . . . . 74.02 110.749 175.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.542 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 3.7 m 68.96 95.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.583 -0.735 . . . . 62.22 111.505 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.658 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -153.39 158.97 42.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.79 -0.641 . . . . 74.43 110.318 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.474 HD13 ' HB3' ' A' ' 117' ' ' LEU . 25.6 mt -87.65 121.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.093 -0.503 . . . . 72.55 110.061 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.4 p -127.13 162.28 32.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 110.256 -0.276 . . . . 54.13 110.256 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.3 t -77.18 130.66 36.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.897 0.38 . . . . 73.33 110.994 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.859 ' HB2' ' HG2' ' A' ' 30' ' ' LYS . 4.3 tp10 -98.32 -47.41 5.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 74.32 110.673 177.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 28' ' ' ILE . 53.8 tptt -156.53 129.75 8.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.275 -0.42 . . . . 70.52 110.743 -173.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.0 m -112.38 135.15 52.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.926 0.393 . . . . 75.45 110.533 175.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.675 ' HA3' ' HE1' ' A' ' 53' ' ' PHE . . . -130.7 148.78 18.88 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.858 -0.687 . . . . 71.24 112.142 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' HIS . 4.4 mm-40 -79.95 168.28 19.41 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.108 -0.33 . . . . 74.04 110.108 -177.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 74.8 tttt -80.5 -21.23 42.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.744 -0.382 . . . . 64.23 111.215 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -100.58 68.71 1.36 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.333 0.587 . . . . 72.21 109.574 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . . . -141.77 153.36 64.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.482 -0.781 . . . . 74.53 110.186 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.25 129.51 21.79 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.614 2.21 . . . . 70.3 111.374 175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.583 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 22.8 p90 -67.12 -27.45 67.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.761 0.315 . . . . 71.14 110.608 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.92 -30.02 70.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 75.21 110.831 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -66.49 -41.05 89.49 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.774 -0.454 . . . . 70.35 109.774 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.675 ' HE1' ' HA3' ' A' ' 44' ' ' GLY . 56.5 m-85 -61.6 -40.74 95.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.886 -0.597 . . . . 71.32 110.45 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.14 -49.26 84.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.764 -0.653 . . . . 72.34 110.353 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.19 -29.31 69.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 74.11 111.554 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.675 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 37.7 mm-40 -62.36 -38.5 89.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.752 0.311 . . . . 75.42 110.895 176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.4 ttp -85.64 -32.26 22.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.976 0.417 . . . . 71.32 110.249 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 58' ' ' LYS . 4.1 tmmm? -58.55 -45.31 89.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.934 -0.575 . . . . 74.34 110.591 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 60.1 pttt -62.71 -20.51 64.96 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.871 0.367 . . . . 64.14 111.401 -179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.2 mt -80.58 -46.21 16.09 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.967 -0.383 . . . . 65.51 109.967 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.44 -29.07 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.961 -0.563 . . . . 73.12 111.694 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 59' ' ' LYS . 13.3 pt-20 -77.73 -20.35 53.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.839 0.352 . . . . 74.11 110.715 179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -97.03 -29.7 13.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.066 -0.515 . . . . 75.21 110.636 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -163.1 160.4 32.94 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.297 -0.721 . . . . 65.42 111.297 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 65' ' ' LYS . 21.9 pttt -81.03 73.73 8.06 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.882 0.848 . . . . 75.52 111.057 -178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 68' ' ' ARG . 45.5 mm-40 -91.39 134.56 34.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.834 -1.076 . . . . 75.44 110.39 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.551 ' SG ' ' HD3' ' A' ' 106' ' ' ARG . 23.6 p -109.02 127.59 54.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.155 -0.683 . . . . 64.4 109.155 173.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.616 ' HB3' HG23 ' A' ' 28' ' ' ILE . 5.3 mmp_? -121.94 143.88 49.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.552 0.215 . . . . 73.11 111.236 -172.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.716 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 91.5 m-85 -81.0 129.39 34.51 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.765 -0.828 . . . . 73.32 108.765 170.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.451 ' HB1' ' HE1' ' A' ' 26' ' ' TYR . . . -118.63 121.87 41.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.034 0.445 . . . . 63.12 111.067 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.74 129.27 49.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.411 -0.589 . . . . 44.13 109.411 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.681 ' HB ' ' HD1' ' A' ' 26' ' ' TYR . 5.3 p -141.41 122.01 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.288 0.566 . . . . 72.12 111.714 -177.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.702 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 5.7 t70 -84.13 115.12 22.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.461 -0.791 . . . . 71.44 109.537 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -132.16 144.69 36.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.246 -0.434 . . . . 71.33 110.457 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.413 ' HB3' ' CA ' ' A' ' 90' ' ' ASN . 9.3 pt-20 -125.65 107.06 10.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.191 0.519 . . . . 75.31 110.481 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 54.6 t -96.07 136.25 27.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.396 -0.594 . . . . 73.44 109.396 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 t -72.35 118.94 15.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.346 0.593 . . . . 62.25 110.805 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 87' ' ' SER . 3.1 t -131.67 132.85 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.928 0 CA-C-N 115.529 -0.76 . . . . 72.11 109.571 176.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 79' ' ' GLN . 8.1 tt0 -71.88 108.31 5.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.982 0.42 . . . . 71.23 110.136 178.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -123.06 -176.0 3.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.793 -0.64 . . . . 72.24 110.041 -177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -73.92 144.17 45.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.996 0.427 . . . . 62.22 110.298 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.09 -75.4 1.92 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 71.54 111.093 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.01 71.84 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.301 -0.629 . . . . 61.44 109.301 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -84.06 96.85 9.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.351 -0.84 . . . . 72.32 110.844 -177.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 157.59 -66.23 0.29 Allowed Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 114.9 -1.046 . . . . 71.33 111.035 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.7 p -144.39 86.61 1.83 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.364 . . . . 74.35 110.953 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 78' ' ' VAL . 13.9 t -99.95 112.09 24.38 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.764 -0.458 . . . . 71.4 109.764 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.0 p -93.64 110.36 21.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.107 -0.497 . . . . 72.52 111.007 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.532 ' HB2' HE21 ' A' ' 150' ' ' GLN . 5.4 mp -107.67 114.48 28.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.593 . . . . 73.02 109.4 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.413 ' CA ' ' HB3' ' A' ' 75' ' ' GLU . 1.5 p30 -88.01 117.44 26.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.146 0.498 . . . . 72.21 110.596 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 150' ' ' GLN . 73.0 mmtt -129.47 127.36 40.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.476 -0.784 . . . . 72.02 110.276 178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.702 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.3 p -83.3 104.84 12.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.475 0.655 . . . . 64.14 109.822 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' ' 146' ' ' LEU . 13.2 tt -92.1 141.59 14.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 63.0 109.819 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.527 ' HD2' ' HG2' ' A' ' 128' ' ' GLN . 46.3 t80 -110.34 121.01 44.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.361 -0.381 . . . . 71.35 110.143 -178.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.4 t -122.97 115.89 47.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.189 -0.459 . . . . 74.35 109.892 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -83.89 129.05 34.94 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.47 -0.332 . . . . 72.23 110.174 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -105.7 103.49 13.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.019 -0.363 . . . . 73.55 110.019 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 52.8 t -168.37 117.88 0.63 Allowed Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.119 -0.492 . . . . 21.3 111.032 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.578 ' HG2' ' HB2' ' A' ' 102' ' ' ALA . 64.0 Cg_endo -76.34 155.01 36.74 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.525 2.15 . . . . 75.25 111.22 172.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -75.76 -29.4 58.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.746 0.308 . . . . 72.51 111.137 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -77.7 -2.53 36.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.284 -0.416 . . . . 75.11 111.127 -177.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 99' ' ' PRO . . . -63.26 153.5 81.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 51.05 110.567 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -44.63 122.77 4.23 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.272 2.648 . . . . 63.43 112.681 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.501 ' HA ' ' HB3' ' A' ' 107' ' ' ARG . 62.1 t -53.72 -35.54 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.7 -0.682 . . . . 53.33 112.386 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.554 ' H ' ' HD3' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -57.58 -44.86 85.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 74.24 110.421 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HD3' ' SG ' ' A' ' 67' ' ' CYS . 34.0 ttm180 -82.94 -35.83 25.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.698 -0.683 . . . . 65.22 110.551 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.501 ' HB3' ' HA ' ' A' ' 104' ' ' VAL . 16.5 tpt180 -59.52 -44.31 93.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.063 -0.517 . . . . 74.43 110.488 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.98 -51.65 68.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.993 -0.549 . . . . 71.42 110.924 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 94.2 mt -59.9 -49.03 79.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.925 -0.579 . . . . 73.33 110.846 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 114' ' ' VAL . 36.0 t80 -63.57 -47.58 80.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.865 -0.607 . . . . 71.1 110.949 -176.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -63.2 -42.33 99.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.972 0.415 . . . . 71.33 111.298 -177.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 43.4 m -67.44 -40.69 85.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.15 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.522 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 23.0 t -72.66 -15.74 61.7 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.259 0.466 . . . . 62.03 112.259 -173.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 110' ' ' TYR . 86.3 t -56.78 -54.36 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 120.626 0.25 . . . . 74.52 111.304 -178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.836 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 2.6 tmt_? -66.59 -33.83 76.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 72.44 110.148 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -58.35 -49.66 76.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.834 -0.621 . . . . 74.43 111.285 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.3 pp -82.95 -25.62 32.17 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.997 -0.281 . . . . 74.55 111.298 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 1.6 tmtt? -60.49 -45.14 94.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 72.44 110.993 -174.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.32 -28.8 26.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.168 -0.469 . . . . 52.45 111.366 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.5 m -83.1 -22.14 33.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.591 0.589 . . . . 75.2 112.591 -173.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.86 18.24 13.6 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.76 -0.376 . . . . 72.14 111.561 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 68.86 21.78 75.3 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.836 -0.697 . . . . 63.52 112.617 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.662 ' HA ' HD23 ' A' ' 126' ' ' LEU . 88.0 mt -91.42 26.43 2.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.781 0.324 . . . . 71.05 110.134 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 125' ' ' SER . 7.9 pt-20 -45.89 -58.49 3.49 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.455 -0.793 . . . . 72.4 112.86 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.516 ' H ' ' HG3' ' A' ' 124' ' ' GLU . 69.4 m -107.07 18.76 21.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.053 0.454 . . . . 74.44 111.034 -178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -88.36 144.03 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.266 -0.642 . . . . 51.01 109.266 175.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.402 ' CE2' HG22 ' A' ' 129' ' ' VAL . 18.4 t80 -77.96 135.38 37.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.938 0.399 . . . . 44.1 110.619 -174.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.527 ' HG2' ' HD2' ' A' ' 94' ' ' PHE . 0.7 OUTLIER -119.49 117.76 29.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.704 -0.68 . . . . 74.32 109.467 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 127' ' ' PHE . 12.4 t -113.27 147.31 16.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 53.2 110.514 -175.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -105.13 132.28 51.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.938 0.399 . . . . 74.2 110.547 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.471 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . . . -123.94 129.43 50.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.495 . . . . 53.43 109.741 176.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 11.5 m -90.27 -54.58 3.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.478 -0.328 . . . . 73.43 111.3 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -120.86 177.16 5.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.958 0.409 . . . . 75.01 111.036 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -64.99 -28.76 69.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.954 -0.566 . . . . 65.45 111.724 -176.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.0 m -77.69 -16.61 58.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.25 0.548 . . . . 62.3 110.474 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 131' ' ' ALA . 30.6 t0 -85.16 -29.7 24.55 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.806 -0.634 . . . . 54.23 111.118 -176.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.1 pp -81.93 4.14 23.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.231 0.539 . . . . 53.33 110.742 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -59.93 146.66 41.5 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.364 -0.835 . . . . 73.54 110.831 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 143' ' ' LYS . 8.1 pt-20 -47.81 -24.11 0.9 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.524 -0.762 . . . . 72.35 112.9 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -46.78 -31.21 2.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.503 0.502 . . . . 73.33 112.179 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.655 ' O ' ' HB2' ' A' ' 145' ' ' ASP . 67.4 m -110.67 -60.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.579 0.228 . . . . 40.03 110.731 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 47.1 t -56.0 -60.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 112.659 0.615 . . . . 60.33 112.659 -170.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.442 ' HB3' ' HB2' ' A' ' 139' ' ' GLU . 4.9 tmmm? -59.82 -49.98 75.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.358 -0.383 . . . . 75.24 111.353 -173.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.8 m -68.86 -22.43 64.21 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.939 0.399 . . . . 71.34 111.495 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 141' ' ' SER . 0.2 OUTLIER -82.06 -52.62 6.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.705 0.288 . . . . 75.04 110.489 -178.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.6 pp -62.37 -29.07 70.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.267 -0.424 . . . . 71.12 111.444 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.453 ' N ' HD12 ' A' ' 146' ' ' LEU . 15.4 tmm? -61.5 -40.17 93.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.238 0.542 . . . . 52.05 110.169 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 32.1 t -80.5 -37.47 31.61 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.841 -0.618 . . . . 24.32 110.174 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -78.82 6.8 8.23 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.066 -0.516 . . . . 62.12 111.485 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 146' ' ' LEU . 20.7 mt-30 -63.37 -25.14 68.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.57 0.224 . . . . 71.3 110.961 176.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.53 98.32 1.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.978 0.894 . . . . 72.04 110.972 172.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 C--O 1.248 0.98 0 CA-C-N 114.835 -1.075 . . . . 70.22 109.241 174.72 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.666 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 81.9 mtp . . . . . 0 N--CA 1.486 1.329 0 N-CA-C 110.101 -0.333 . . . . 75.54 110.101 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.72 -97.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.747 0.308 . . . . 53.13 110.619 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.7 m -155.61 172.43 18.29 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.74 -0.467 . . . . 75.31 109.74 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.1 -27.1 3.48 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 111.49 -0.644 . . . . 72.35 111.49 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.667 HG21 ' HB2' ' A' ' 113' ' ' SER . 41.8 t -87.74 141.51 14.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.795 0.331 . . . . 74.34 110.128 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -83.75 129.34 34.95 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.374 0.606 . . . . 73.13 111.388 -176.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.9 m -89.44 102.15 12.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.29 -0.868 . . . . 73.12 110.251 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 10.3 t70 -88.69 125.54 62.68 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.144 -0.48 . . . . 52.13 110.059 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 32.0 Cg_exo -59.7 -13.7 23.08 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.348 2.699 . . . . 72.51 113.766 -175.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.2 m -62.09 -30.78 71.24 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.77 0.319 . . . . 71.34 110.958 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 30.0 p -82.93 -35.26 26.18 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.974 0.416 . . . . 75.11 110.243 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.463 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 23.7 tptp -68.93 -41.32 78.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.979 -0.555 . . . . 61.11 110.672 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.429 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 25.7 t-20 -62.1 -35.26 78.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.079 0.466 . . . . 74.25 110.215 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -31.79 54.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.918 -0.583 . . . . 71.53 110.325 178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.588 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 79.8 t80 -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.588 -0.733 . . . . 71.32 110.815 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -58.99 -32.98 70.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.795 0.331 . . . . 71.34 110.849 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 92.0 mt -59.81 -42.54 93.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 70.03 111.168 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.815 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 3.9 pp -84.75 -31.82 23.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.621 0.248 . . . . 71.53 111.417 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -68.88 -48.79 62.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 64.5 111.221 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -95.41 -68.14 0.82 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.948 0.404 . . . . 75.31 110.54 -175.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -29.09 69.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.668 -0.696 . . . . 73.44 110.763 -176.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 26.0 m80 63.08 37.6 11.44 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.541 0.686 . . . . 64.13 110.438 -174.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.16 -38.06 81.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.965 -1.016 . . . . 71.23 109.26 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.815 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 96.2 m-70 -107.97 159.61 16.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.181 -0.674 . . . . 72.31 109.181 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 1.052 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 9.0 t -106.76 -40.56 5.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.858 -0.423 . . . . 62.04 109.858 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.422 ' HB3' HG23 ' A' ' 72' ' ' VAL . 52.7 p90 -139.54 151.28 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.367 -0.379 . . . . 65.04 110.755 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 40' ' ' VAL . 12.2 tt -143.74 138.31 25.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.983 -0.553 . . . . 71.05 110.347 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.435 ' HB ' ' HB3' ' A' ' 41' ' ' GLU . 42.7 mt -101.32 141.83 17.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.71 -0.478 . . . . 73.33 109.71 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.769 ' HB2' ' HB2' ' A' ' 69' ' ' TYR . 97.3 m-85 -123.4 150.96 43.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.45 0.167 . . . . 72.21 110.869 -178.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.917 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -149.96 145.79 26.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.884 0.373 . . . . 71.51 110.853 170.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -78.47 123.53 35.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.905 -0.776 . . . . 72.35 108.905 172.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.786 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 3.2 t70 -132.93 -177.97 4.74 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.956 -0.298 . . . . 63.42 110.398 -173.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.888 ' HD3' ' HB3' ' A' ' 37' ' ' ALA . 0.6 OUTLIER 54.06 158.75 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.494 1.518 . . . . 75.1 114.002 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.29 -26.14 63.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.276 -0.875 . . . . 74.41 111.606 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 9.79 13.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 72.25 110.342 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.5 p 50.4 86.22 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.018 -0.992 . . . . 74.43 112.806 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.888 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -127.63 145.53 50.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 44.01 110.561 178.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.737 HD13 ' HB3' ' A' ' 117' ' ' LEU . 45.7 mt -83.88 122.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 61.12 109.97 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.71 161.32 30.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.784 0.325 . . . . 54.21 110.466 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 HG13 ' A' ' 43' ' ' VAL . 61.1 t -69.49 138.4 22.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.941 -0.572 . . . . 70.45 111.344 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.679 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 6.9 tp10 -97.22 -48.16 5.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.896 -0.593 . . . . 63.23 109.79 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OE2' ' A' ' 56' ' ' GLU . 24.5 tptp -162.15 129.5 3.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 63.35 110.335 -176.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG13 HG11 ' A' ' 40' ' ' VAL . 21.6 m -103.3 143.87 14.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.798 0.332 . . . . 70.31 110.772 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.05 141.26 12.45 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.251 -0.74 . . . . 73.3 111.251 176.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -79.35 165.16 23.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.745 0.272 . . . . 71.43 110.969 -174.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 1.052 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 8.3 mmtt -66.98 -21.96 65.94 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.726 0.298 . . . . 73.21 111.566 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.27 0.68 56.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.767 0.318 . . . . 60.35 111.059 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -92.65 128.94 42.14 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.202 -0.454 . . . . 44.0 110.297 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 15.6 Cg_exo -67.6 148.57 78.49 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.718 2.279 . . . . 72.42 112.296 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.402 ' O ' ' HB3' ' A' ' 53' ' ' PHE . 52.0 p90 -64.35 -20.64 66.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.881 0.372 . . . . 74.53 110.478 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.67 -37.83 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.97 -0.559 . . . . 44.3 110.901 175.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -72.77 -33.76 66.52 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.048 0.451 . . . . 75.0 109.893 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.51 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 39.8 t80 -57.33 -45.41 84.31 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.759 -0.655 . . . . 63.4 110.183 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.3 t -60.68 -50.73 79.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.744 -0.662 . . . . 62.12 110.422 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -54.9 -44.61 74.31 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.477 0.547 . . . . 53.52 112.477 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.43 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 8.5 mm-40 -60.59 -42.58 97.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.852 0.316 . . . . 71.24 111.852 -178.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 59.1 ttp -79.38 -33.14 43.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.919 0.39 . . . . 73.52 110.288 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -55.93 -49.23 74.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.458 -0.792 . . . . 74.41 111.358 -178.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -61.13 -29.3 69.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.804 0.335 . . . . 74.05 111.46 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.27 -48.0 8.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 70.22 111.447 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.433 HG12 ' HA ' ' A' ' 58' ' ' LYS . 8.1 p -68.65 -23.67 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.578 0.584 . . . . 71.33 112.578 -170.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 52.4 mt-10 -65.09 -14.0 59.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.668 0.27 . . . . 62.43 111.725 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.88 -27.01 68.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 61.31 109.862 173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.34 -33.1 5.48 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.051 -0.595 . . . . 70.12 112.454 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -99.96 54.35 0.92 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.135 0.493 . . . . 73.03 110.388 -177.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.46 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 3.4 mm-40 -136.28 159.45 41.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.551 0.691 . . . . 71.05 112.504 -177.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 37.4 t -164.21 127.5 2.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.681 -1.145 . . . . 65.43 107.943 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.917 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -149.32 149.68 31.28 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.252 -0.579 . . . . 72.04 111.776 -171.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.769 ' HB2' ' HB2' ' A' ' 29' ' ' PHE . 53.0 m-85 -84.93 141.77 30.14 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.757 -0.46 . . . . 75.1 109.757 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -136.57 138.12 40.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.745 0.307 . . . . 64.34 110.981 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -138.17 134.1 34.11 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.902 -0.407 . . . . 74.34 109.902 176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.422 HG23 ' HB3' ' A' ' 26' ' ' TYR . 7.6 p -146.19 134.35 15.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.133 0.492 . . . . 61.31 111.89 -177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 10.1 t70 -89.04 110.22 20.95 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.938 -0.764 . . . . 71.15 108.938 173.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.04 136.84 56.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 120.874 0.369 . . . . 64.5 110.849 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.861 ' HB3' ' HB3' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -108.6 133.34 52.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.903 -0.589 . . . . 73.02 111.177 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 52.0 t -118.57 133.54 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.029 -0.532 . . . . 72.34 110.436 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -98.17 118.89 35.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.396 0.617 . . . . 73.13 110.663 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -143.94 -174.04 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.733 -0.667 . . . . 74.33 110.511 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.671 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 49.6 tt0 -119.37 105.92 11.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.171 -0.678 . . . . 73.43 109.171 166.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.671 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 13.9 mmm180 -134.01 -171.59 2.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.327 -0.99 . . . . 73.44 108.327 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.19 125.83 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.926 0.393 . . . . 61.03 110.623 176.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 126.57 -35.23 2.97 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.607 -0.597 . . . . 74.4 111.607 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.73 131.06 16.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.684 0.278 . . . . 51.01 110.466 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -89.61 -0.56 57.6 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.209 -0.45 . . . . 73.14 111.015 -176.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -119.68 -77.37 0.52 Allowed Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.844 -0.616 . . . . 71.32 111.593 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.3 p -125.64 95.46 4.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.422 0.629 . . . . 53.4 111.29 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.9 t -83.15 104.54 13.42 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.235 -1.024 . . . . 75.52 108.235 173.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -118.02 112.21 19.96 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.053 -0.521 . . . . 64.53 110.624 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 5.4 mp -118.7 146.02 45.05 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.219 -0.66 . . . . 73.25 109.219 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.861 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 20.7 p-10 -119.27 128.33 54.06 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.887 -0.412 . . . . 71.34 109.887 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -126.78 134.77 50.52 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.909 -0.587 . . . . 71.51 110.172 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.2 p -81.27 103.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.637 0.732 . . . . 74.44 109.693 173.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 12.4 tt -100.19 140.67 18.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.435 -0.802 . . . . 72.53 110.212 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.649 ' HD2' ' HG3' ' A' ' 128' ' ' GLN . 66.7 t80 -102.51 121.01 41.5 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.108 -0.497 . . . . 64.25 109.66 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 47.0 t -119.12 102.01 12.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.325 -0.398 . . . . 63.13 110.051 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -83.43 114.64 21.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.178 0.514 . . . . 72.31 110.45 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -86.29 109.55 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.252 -0.431 . . . . 73.25 109.887 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.9 98.08 3.6 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.098 -0.501 . . . . 74.54 110.775 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -68.58 153.52 73.4 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.71 2.273 . . . . 54.11 111.629 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -68.48 -20.11 64.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.795 0.331 . . . . 71.23 110.826 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -89.26 -0.69 57.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.011 -0.541 . . . . 64.1 110.875 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.04 129.56 94.53 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.604 -0.271 . . . . 71.24 110.399 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -48.82 128.45 18.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.226 2.617 . . . . 62.44 112.704 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.659 ' HA ' ' HG2' ' A' ' 107' ' ' ARG . 47.7 t -56.79 -41.32 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.004 -0.544 . . . . 72.43 110.875 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 105' ' ' ARG . 5.2 tpp180 -57.24 -37.81 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 74.21 110.988 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -87.49 -39.09 15.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.993 0.425 . . . . 75.32 110.658 -176.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.659 ' HG2' ' HA ' ' A' ' 104' ' ' VAL . 23.6 ptt180 -78.33 -21.42 49.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.379 -0.373 . . . . 70.22 111.899 -174.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.4 tpt -62.47 -41.0 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.918 0.39 . . . . 64.51 110.23 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.9 mt -65.03 -45.37 85.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 70.03 109.691 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.425 ' O ' HG23 ' A' ' 114' ' ' VAL . 54.7 t80 -57.04 -50.99 71.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.074 -0.966 . . . . 61.2 110.774 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 1' ' ' MET . . . -65.54 -32.93 74.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.008 -0.542 . . . . 62.31 111.534 -177.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.666 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 56.5 m -78.43 -28.8 46.77 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 121.043 -0.263 . . . . 71.3 111.484 -178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.667 ' HB2' HG21 ' A' ' 5' ' ' VAL . 33.3 t -77.45 -17.57 57.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.458 -0.337 . . . . 60.1 111.085 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 110' ' ' TYR . 88.7 t -54.24 -57.0 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.35 -0.386 . . . . 72.01 111.687 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.441 ' HD3' ' C ' ' A' ' 115' ' ' ARG . 1.6 tmt_? -59.09 -35.57 73.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.328 -0.396 . . . . 64.54 110.826 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -62.13 -53.55 53.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.355 -0.384 . . . . 70.21 111.426 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.737 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.0 pp -75.36 -31.71 60.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.521 -0.308 . . . . 64.11 111.409 -177.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.492 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.5 tmtt? -66.87 -48.17 69.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.943 0.402 . . . . 74.52 111.003 -177.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.31 -49.82 17.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 53.25 111.822 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 72.1 m -77.34 -17.08 58.57 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.28 0.845 . . . . 44.13 113.28 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 117' ' ' LEU . 11.0 mp -91.58 0.91 57.45 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.21 -0.596 . . . . 72.42 110.672 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 85.06 25.5 40.43 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.731 -0.747 . . . . 64.51 113.099 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 126' ' ' LEU . 9.0 mp -94.77 18.84 10.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 110.091 -0.337 . . . . 73.03 110.091 177.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.413 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 7.4 mm-40 -52.93 -48.53 67.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.848 -0.615 . . . . 73.24 112.37 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.2 p -103.73 16.8 25.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.821 0.343 . . . . 73.34 111.297 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' A' ' 123' ' ' LEU . 4.4 mm? -95.44 -176.96 3.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.419 . . . . 51.32 110.848 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -103.28 120.57 41.0 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.184 -0.462 . . . . 74.51 111.122 -173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.649 ' HG3' ' HD2' ' A' ' 94' ' ' PHE . 28.3 tt0 -120.92 119.62 33.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.055 -0.52 . . . . 73.25 110.063 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.469 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 58.6 t -120.77 145.57 27.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.145 -0.479 . . . . 71.12 109.731 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -106.88 133.2 51.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.809 0.338 . . . . 75.31 110.654 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 137' ' ' LEU . . . -115.71 142.97 46.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 51.5 110.202 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.0 m -115.24 -64.67 1.28 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.921 0.391 . . . . 75.21 111.051 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 136' ' ' ASP . 10.9 tp10 -80.85 154.17 27.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.887 -0.597 . . . . 75.44 109.643 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.092 0.473 . . . . 72.42 110.635 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.598 ' H ' ' HG3' ' A' ' 133' ' ' GLU . 14.4 m -80.45 -15.13 57.51 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.931 -0.577 . . . . 73.11 110.604 178.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.691 ' HB2' ' HB3' ' A' ' 133' ' ' GLU . 37.8 t70 -68.09 -31.61 71.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.588 -0.733 . . . . 62.14 111.731 -172.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.847 HD13 ' H ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -96.47 12.37 31.67 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.884 -0.326 . . . . 63.33 111.816 -179.196 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -59.66 144.81 46.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.737 -0.468 . . . . 61.0 109.737 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -51.13 -23.51 3.27 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.582 0.586 . . . . 72.11 112.582 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -28.43 37.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.799 0.296 . . . . 62.5 111.799 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 50.7 m -106.84 -61.04 1.59 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 121.022 -0.271 . . . . 63.52 110.548 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.403 HG12 HD23 ' A' ' 146' ' ' LEU . 79.9 t -59.87 -55.58 23.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.302 0.482 . . . . 74.23 112.302 -171.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 6.1 tmmm? -66.29 -35.4 80.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.811 0.339 . . . . 73.4 111.208 -175.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.0 m -71.99 -36.31 69.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.928 0.394 . . . . 75.31 110.849 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.61 -42.34 61.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.025 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.403 HD23 HG12 ' A' ' 142' ' ' VAL . 4.7 pp -70.29 -19.3 63.11 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.381 -0.372 . . . . 72.1 110.682 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -68.48 -46.19 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.999 -0.371 . . . . 65.45 109.999 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 6.4 m -67.54 -38.1 83.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.054 -0.521 . . . . 70.23 110.878 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.526 ' HA ' ' CG1' ' A' ' 152' ' ' ILE . 51.8 m-80 -95.21 14.12 23.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.973 -0.558 . . . . 72.22 111.188 -176.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -64.45 -30.26 71.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.731 0.641 . . . . 61.21 112.731 -171.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 23.69 0.41 Allowed 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.373 0.508 . . . . 74.43 112.373 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.543 ' OXT' HD12 ' A' ' 152' ' ' ILE . 1.5 pp . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.249 -0.881 . . . . 74.2 111.507 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.649 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 64.7 mtt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.55 0.214 . . . . 54.32 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 138.19 13.44 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.585 -0.28 . . . . 74.32 110.602 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t -164.43 -71.11 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.186 -0.461 . . . . 71.22 109.982 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.35 52.23 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.562 -0.828 . . . . 45.54 112.408 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t -78.73 122.56 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 109.635 -0.505 . . . . 53.14 109.635 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -79.41 141.08 37.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.997 0.427 . . . . 74.41 111.099 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 120' ' ' SER . 27.2 m -95.57 143.3 12.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.049 -0.523 . . . . 72.02 110.786 178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -90.09 137.42 27.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.813 -0.631 . . . . 70.13 111.601 -177.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 17.5 Cg_exo -68.33 -19.39 43.84 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.349 2.7 . . . . 72.42 113.265 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -71.63 -40.97 69.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.922 0.391 . . . . 73.35 110.047 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.8 m -60.68 -40.25 91.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.974 -0.557 . . . . 72.44 110.091 174.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -68.32 -37.37 80.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.724 -0.671 . . . . 74.44 110.447 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' ASN . 0.2 OUTLIER -57.46 -39.17 75.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.743 -0.662 . . . . 63.45 109.618 175.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.72 -34.38 52.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.752 -0.658 . . . . 74.33 110.68 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.455 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 80.6 t80 -57.64 -47.1 83.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.635 -0.711 . . . . 71.14 111.142 178.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -59.23 -36.57 75.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.106 0.479 . . . . 75.12 110.693 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 85.3 mt -67.71 -37.29 82.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.874 -0.603 . . . . 74.12 111.251 -179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.5 pp -83.23 -28.52 29.17 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.782 -0.367 . . . . 71.31 111.0 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.9 t60 -69.66 -52.01 29.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.562 -0.29 . . . . 71.03 110.776 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.24 -58.87 2.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.839 0.352 . . . . 72.2 111.403 -176.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 11.2 mmpt? -82.66 -24.06 33.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.673 -173.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 57.8 m-70 58.31 35.93 25.23 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.062 -0.718 . . . . 75.02 109.062 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.84 -27.74 66.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 114.834 -1.075 . . . . 72.32 110.64 -175.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -117.38 121.04 39.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.14 -0.482 . . . . 72.11 109.714 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.686 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 75.3 m -79.45 -26.08 41.82 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 121.021 -0.272 . . . . 64.04 111.475 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -148.38 148.81 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.26 -0.576 . . . . 72.4 111.721 177.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' VAL . 11.4 tt -143.55 141.54 25.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.399 -0.819 . . . . 62.22 109.236 171.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.1 mt -103.3 133.16 47.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.714 0.292 . . . . 71.44 110.485 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.668 ' HD2' ' H ' ' A' ' 69' ' ' TYR . 21.6 t80 -97.75 138.67 34.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.36 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.91 ' HB2' ' HB2' ' A' ' 41' ' ' GLU . 1.3 tmtp? -136.0 127.56 28.79 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.87 -0.789 . . . . 73.23 108.87 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.1 tt -86.19 113.95 24.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.48 0.657 . . . . 63.0 109.436 178.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 4.8 t70 -129.84 -168.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.685 -0.857 . . . . 73.13 108.685 -175.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 1.5 tpmt? 69.46 125.3 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.106 0 O-C-N 123.621 0.575 . . . . 74.24 110.403 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -65.33 -26.98 68.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.304 0.573 . . . . 71.22 109.885 177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.567 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 19.3 t70 -76.47 3.39 11.33 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.36 -0.836 . . . . 71.5 110.068 173.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 37.2 p 56.91 101.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.829 1.252 . . . . 73.52 112.691 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -144.36 152.59 40.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.408 -0.815 . . . . 72.12 111.015 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.434 HG13 ' CE1' ' A' ' 29' ' ' PHE . 2.3 mp -75.88 134.77 28.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.522 -0.763 . . . . 71.21 109.739 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -148.28 155.74 9.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-O 121.049 0.452 . . . . 61.24 110.79 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.406 HG22 HD11 ' A' ' 27' ' ' ILE . 57.5 t -82.71 128.48 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.84 -0.618 . . . . 73.14 110.501 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.91 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 10.8 tp10 -89.33 -50.36 6.17 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.03 -0.729 . . . . 75.3 109.03 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 9.1 mptt -148.75 156.92 43.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.796 -0.638 . . . . 71.21 109.752 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 27' ' ' ILE . 11.2 p -145.81 141.44 21.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.384 -0.599 . . . . 74.4 109.384 177.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.94 174.75 15.54 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.614 -0.803 . . . . 72.34 112.334 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -93.36 179.15 5.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.441 0.163 . . . . 62.43 110.944 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.686 ' HA ' ' OG ' ' A' ' 25' ' ' SER . 52.6 pttt -84.68 2.91 39.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.459 0.647 . . . . 71.32 110.282 176.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -98.82 9.95 42.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.558 -0.746 . . . . 74.03 109.575 177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -112.6 114.91 49.62 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.512 -0.767 . . . . 55.33 111.389 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.23 -172.17 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.749 2.299 . . . . 71.31 111.935 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' O ' HG23 ' A' ' 54' ' ' VAL . 47.1 p90 -70.65 -31.96 69.08 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.798 -0.361 . . . . 64.44 111.577 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.07 -41.29 95.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.873 0.368 . . . . 72.33 110.647 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -55.06 -47.99 74.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.623 -0.717 . . . . 74.14 109.329 175.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.681 ' HZ ' ' HB1' ' A' ' 70' ' ' ALA . 25.5 t80 -60.32 -50.01 75.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.126 -0.943 . . . . 53.11 111.435 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 50' ' ' TYR . 80.0 t -56.88 -51.05 72.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 45.24 111.021 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -54.61 -49.96 69.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.781 0.324 . . . . 64.43 111.589 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.869 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 6.7 mm-40 -64.97 -28.89 69.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 73.43 111.296 -178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.478 ' O ' HG23 ' A' ' 61' ' ' VAL . 54.1 ttp -86.13 -51.66 6.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.424 0.527 . . . . 64.45 112.424 -176.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -65.3 -21.7 66.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.328 0.862 . . . . 74.05 113.328 -168.114 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 46.8 pttt -73.13 -25.24 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.412 -0.515 . . . . 71.35 110.78 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.59 ' HB3' HH22 ' A' ' 68' ' ' ARG . 4.1 mm? -85.83 -13.56 47.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.318 0.58 . . . . 65.04 110.131 174.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.517 ' HA ' ' HG3' ' A' ' 66' ' ' GLU . 96.0 t -85.18 -17.23 9.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.459 -0.791 . . . . 61.35 111.354 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -53.86 -15.98 1.58 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.519 0.933 . . . . 75.41 113.519 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.88 -14.87 60.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.125 0.488 . . . . 53.04 110.415 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.02 -69.34 3.33 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.98 -0.555 . . . . 44.34 112.549 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.623 ' HB3' ' HA ' ' A' ' 102' ' ' ALA . 40.9 mtmt -88.05 70.02 9.34 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.685 0.755 . . . . 65.34 110.35 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HG3' ' HA ' ' A' ' 61' ' ' VAL . 37.2 mm-40 -98.17 164.35 12.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.755 -1.111 . . . . 75.15 111.936 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.412 ' H ' ' NH2' ' A' ' 106' ' ' ARG . 56.9 m -144.46 125.08 14.06 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.414 -0.958 . . . . 55.22 108.414 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.59 HH22 ' HB3' ' A' ' 60' ' ' LEU . 19.0 ptp180 -172.55 148.08 1.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.234 0.334 . . . . 63.22 110.831 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.668 ' H ' ' HD2' ' A' ' 29' ' ' PHE . 23.0 m-85 -93.47 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.245 -0.434 . . . . 72.25 109.91 174.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.681 ' HB1' ' HZ ' ' A' ' 53' ' ' PHE . . . -119.93 122.69 41.8 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.041 -0.527 . . . . 72.31 110.143 178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -113.16 119.3 37.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.569 -0.287 . . . . 61.13 110.46 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -135.22 129.9 50.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.139 0.495 . . . . 73.32 111.169 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.574 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 27.3 t70 -104.01 121.14 42.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.485 -0.779 . . . . 74.44 109.901 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.1 p -135.1 134.61 53.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.079 -0.51 . . . . 75.24 110.234 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.826 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.2 OUTLIER -94.88 106.84 18.86 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.707 0.765 . . . . 55.31 110.496 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 t -99.94 126.38 53.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.718 -0.674 . . . . 74.31 109.966 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 5.0 t -80.6 120.2 24.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.381 0.61 . . . . 75.35 110.33 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.0 t -139.24 156.28 27.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.437 -0.801 . . . . 74.32 109.525 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -84.4 106.26 15.86 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.357 -0.537 . . . . 54.24 109.813 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -124.14 160.92 26.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.814 -1.18 . . . . 72.23 107.814 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -64.78 115.23 5.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.198 0.523 . . . . 73.55 110.454 -177.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.53 -28.38 2.67 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.34 -1.104 . . . . 74.15 110.34 -172.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.77 ' HB3' ' HB2' ' A' ' 87' ' ' SER . . . -142.5 119.09 11.03 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.883 -0.414 . . . . 74.01 109.883 176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -83.05 8.99 11.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.265 -0.425 . . . . 52.25 111.527 -173.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.65 -82.97 0.13 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.588 -0.815 . . . . 72.34 112.224 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -124.42 105.47 9.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.114 0.483 . . . . 72.52 111.605 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.77 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 10.0 t -107.13 106.26 16.67 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.826 -0.805 . . . . 60.41 108.826 174.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.616 HG22 ' HB2' ' A' ' 75' ' ' GLU . 6.4 m -93.46 110.98 22.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.361 -0.381 . . . . 63.11 110.567 -178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 5.3 mp -116.24 119.69 36.56 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.879 -0.601 . . . . 72.13 109.627 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 1.5 p30 -82.54 131.8 35.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.164 0.506 . . . . 73.42 110.531 176.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 91' ' ' LYS . 71.9 mmtt -129.89 115.48 17.27 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.545 -0.752 . . . . 70.34 110.483 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -80.62 108.49 14.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.579 0.704 . . . . 71.02 109.765 175.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.2 tt -95.7 140.77 16.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.488 -0.778 . . . . 72.45 110.435 -177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 128' ' ' GLN . 1.5 t80 -108.4 107.22 17.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 74.52 109.185 -178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 122.37 60.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.354 -0.385 . . . . 74.2 111.261 -174.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 69' ' ' TYR . 18.8 pt20 -83.91 120.6 26.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.017 0.437 . . . . 75.12 110.135 174.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -108.64 112.73 25.22 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.137 -0.483 . . . . 63.12 109.929 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 23.2 p -170.18 112.27 0.46 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.081 -0.508 . . . . 74.2 110.851 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.422 ' HD2' ' O ' ' A' ' 66' ' ' GLU . 47.8 Cg_endo -74.43 167.78 26.34 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.411 2.074 . . . . 53.23 112.125 174.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -73.89 -16.61 61.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 74.43 111.635 -175.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -83.56 -2.25 55.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 74.21 111.12 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.623 ' HA ' ' HB3' ' A' ' 65' ' ' LYS . . . -60.12 140.84 90.75 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.421 -0.354 . . . . 72.31 111.876 -176.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.579 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 6.5 Cg_endo -49.31 133.34 30.29 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.696 2.931 . . . . 73.51 112.658 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.451 ' HA ' ' NE ' ' A' ' 107' ' ' ARG . 40.3 t -52.13 -58.34 2.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.655 -0.702 . . . . 72.24 112.326 -172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -34.36 77.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.48 -0.327 . . . . 73.5 111.488 -175.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.412 ' NH2' ' H ' ' A' ' 67' ' ' CYS . 77.9 ttt180 -66.35 -55.49 15.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.0 -0.28 . . . . 73.33 111.077 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.688 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 1.8 ppt_? -75.8 -19.05 59.26 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.607 -0.437 . . . . 74.34 111.756 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 tpp -62.85 -47.56 82.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.74 -0.467 . . . . 71.31 109.74 171.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.36 -41.87 84.39 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 72.21 110.007 175.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.688 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 90.1 t80 -57.35 -42.63 82.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.241 -0.89 . . . . 74.41 110.919 177.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.649 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -67.44 -33.09 74.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 62.31 110.953 178.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.406 ' HA ' ' C ' ' A' ' 1' ' ' MET . 44.3 m -68.99 -26.29 64.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.25 -0.432 . . . . 54.55 111.361 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 8.3 p -87.42 -9.74 53.85 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.074 0.398 . . . . 74.1 112.074 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 111' ' ' ALA . 73.4 t -53.53 -58.12 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.951 0.405 . . . . 73.11 111.939 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.33 -20.63 65.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 62.32 111.502 -177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.65 -57.78 3.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.349 -0.387 . . . . 72.53 111.463 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.61 HD13 ' HE2' ' A' ' 94' ' ' PHE . 2.5 pp -70.0 -29.47 66.56 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.106 0.41 . . . . 74.41 112.106 -174.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.541 ' N ' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -60.65 -46.05 91.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 73.11 111.314 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -84.76 -44.91 12.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.255 -0.43 . . . . 64.05 111.594 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.532 ' HB2' HG11 ' A' ' 7' ' ' VAL . 20.4 m -66.97 -30.34 70.44 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.503 0.557 . . . . 73.11 112.503 -172.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 mp -89.72 -1.0 57.89 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.826 -0.35 . . . . 72.13 111.251 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 71.84 42.27 53.62 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.64 -0.79 . . . . 64.33 112.431 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.716 ' HA ' HD23 ' A' ' 126' ' ' LEU . 90.1 mt -107.85 19.31 20.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.179 0.514 . . . . 50.55 110.302 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -62.61 -48.95 77.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.696 -0.684 . . . . 73.23 110.978 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -81.98 8.92 9.31 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.067 -0.515 . . . . 70.32 111.387 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.716 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.4 mm? -106.59 168.2 9.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.907 0.384 . . . . 74.42 110.556 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -91.1 137.83 32.06 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.235 -0.439 . . . . 73.35 110.912 -175.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.615 ' HA ' ' O ' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -125.84 117.6 23.71 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.933 -0.765 . . . . 71.22 108.933 178.219 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.0 t -126.2 146.81 31.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.269 -0.423 . . . . 51.25 110.25 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 130' ' ' GLN . 0.4 OUTLIER -98.0 136.51 38.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.966 0.412 . . . . 44.45 111.36 -177.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -130.12 138.64 50.77 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 72.11 109.621 175.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 m -93.84 -61.61 1.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.681 -0.408 . . . . 62.31 111.407 -176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -121.79 -177.76 3.65 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.096 0.474 . . . . 74.4 111.799 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -65.81 -27.43 68.26 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.625 -0.716 . . . . 74.53 112.421 -175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.3 m -81.2 -18.3 46.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.371 0.605 . . . . 73.03 110.094 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -85.27 -28.77 25.11 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 63.41 110.952 -176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.56 6.32 10.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.262 0.553 . . . . 73.11 110.836 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.66 145.53 33.86 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.413 -0.812 . . . . 63.23 110.45 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -50.57 -23.48 2.58 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.828 -0.624 . . . . 73.32 112.552 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.07 -31.7 3.55 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 122.96 0.504 . . . . 65.3 112.301 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 73.4 m -111.3 -54.87 2.56 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.833 -0.347 . . . . 64.14 110.816 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.61 -60.66 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.186 0.439 . . . . 74.25 112.186 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.409 ' HB3' ' HE2' ' A' ' 143' ' ' LYS . 5.8 tmmm? -62.43 -46.28 89.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.34 -0.391 . . . . 74.34 111.051 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 26.6 m -69.43 -32.72 71.85 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.075 0.398 . . . . 74.54 112.075 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -69.98 -50.44 41.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.59 0.234 . . . . 73.14 110.942 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 -26.57 66.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.713 0.292 . . . . 74.4 110.786 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 59.1 ttp -72.03 -41.04 67.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.031 0.443 . . . . 74.33 110.311 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 45.5 t -66.85 -56.96 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.832 -0.622 . . . . 63.45 110.17 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -60.73 -62.77 1.62 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.935 -0.575 . . . . 72.23 110.084 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 151' ' ' ARG . 21.3 tt0 38.54 -89.51 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 O-C-N 124.51 1.131 . . . . 75.4 111.955 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.607 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -140.84 106.43 5.09 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.625 0.726 . . . . 74.43 109.097 168.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.417 ' OXT' HD12 ' A' ' 152' ' ' ILE . 2.0 pp . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.314 -0.85 . . . . 55.35 110.854 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' HA ' ' O ' ' A' ' 111' ' ' ALA . 72.8 mtm . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.714 0.292 . . . . 73.25 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.02 109.69 7.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.988 0.423 . . . . 73.41 111.661 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.0 p -149.13 -177.49 5.85 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.282 -0.636 . . . . 74.53 109.282 174.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.11 84.87 1.02 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.9 -0.667 . . . . 44.31 112.409 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -102.5 114.28 41.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.817 0.341 . . . . 73.15 110.172 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -61.16 123.3 17.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.538 -0.755 . . . . 74.12 111.477 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.93 143.41 12.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 75.32 110.348 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 10' ' ' SER . 23.0 t70 -107.87 129.22 24.44 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.359 -0.382 . . . . 51.53 111.325 -177.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.39 -28.42 39.2 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 123.066 2.51 . . . . 74.32 112.909 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.415 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 15.0 m -70.32 -36.88 74.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.832 0.349 . . . . 72.24 110.254 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.632 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 61.4 m -62.91 -44.32 96.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 61.41 110.602 175.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.526 ' HD3' ' HG ' ' A' ' 121' ' ' LEU . 39.4 tptt -65.28 -40.58 94.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.405 -0.361 . . . . 63.34 110.287 176.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.8 t30 -57.12 -43.45 82.35 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.26 -0.427 . . . . 42.53 110.448 175.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.84 -35.59 64.82 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.119 -0.491 . . . . 65.44 110.811 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.667 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 53.7 t80 -68.27 -43.66 77.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.967 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.743 ' HA ' ' HB3' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -70.07 -20.99 63.19 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.816 -0.353 . . . . 33.23 110.678 -175.727 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 88.9 mt -55.15 -42.96 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.421 -0.354 . . . . 72.52 110.339 173.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.4 pp -84.46 -33.45 23.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.717 0.294 . . . . 73.31 111.052 176.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.743 ' HB3' ' HA ' ' A' ' 16' ' ' ASP . 25.4 t60 -67.13 -38.05 84.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.043 -0.526 . . . . 75.4 111.622 -176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -105.84 -53.88 2.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.95 0.405 . . . . 71.24 111.744 -175.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 12.9 tmtt? -89.55 -28.17 19.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.515 . . . . 75.4 111.275 -171.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 73.6 36.55 0.76 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.766 0.794 . . . . 74.53 109.281 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -73.14 -24.47 60.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.322 -0.854 . . . . 71.05 110.815 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -134.81 172.5 12.89 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.204 -0.665 . . . . 73.23 109.204 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 48.4 t -117.37 -38.89 3.25 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.766 0.317 . . . . 71.14 110.577 176.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -118.76 141.1 48.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.526 -0.306 . . . . 74.31 110.486 -176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.501 HD11 HG13 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -145.41 123.36 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 121.124 0.488 . . . . 73.42 110.027 168.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.526 HD12 ' HB3' ' A' ' 42' ' ' LYS . 51.7 mt -101.49 135.8 36.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.48 -0.327 . . . . 74.33 110.866 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HE1' ' HB3' ' A' ' 11' ' ' CYS . 91.0 m-85 -112.87 159.58 18.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.909 0.385 . . . . 75.23 110.779 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HD3' ' OE2' ' A' ' 41' ' ' GLU . 22.2 pttm -149.02 156.63 42.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.114 -0.494 . . . . 63.21 109.973 174.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.5 tt -100.77 121.84 52.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.158 0.504 . . . . 53.21 109.756 174.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.699 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 28.3 t70 -121.84 155.87 34.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.233 -0.44 . . . . 73.03 111.063 -173.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 13.6 ptpt 64.75 154.89 0.07 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.294 1.438 . . . . 72.12 113.531 171.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -69.76 -27.88 65.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 65.44 109.651 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.92 -4.51 16.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 72.33 110.584 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.1 p 59.52 120.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.75 1.22 . . . . 73.33 111.876 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.31 118.19 2.56 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.669 -0.696 . . . . 71.12 110.352 176.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 117' ' ' LEU . 72.3 mt -76.16 122.13 29.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.081 -1.081 . . . . 75.23 108.081 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.632 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 10.2 p -138.23 149.12 24.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 120.702 0.287 . . . . 50.0 110.646 -174.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG13 HD11 ' A' ' 27' ' ' ILE . 58.0 t -56.54 134.35 20.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.855 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HD3' ' A' ' 30' ' ' LYS . 4.8 tp10 -104.87 -47.28 4.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.543 . . . . 64.3 109.911 175.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 28' ' ' ILE . 28.3 tptp -158.52 128.55 5.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.882 -0.599 . . . . 72.14 110.79 -178.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.4 p -107.36 140.06 26.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 109.786 -0.45 . . . . 72.42 109.786 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -116.92 155.27 16.28 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.937 -0.465 . . . . 51.3 111.937 -178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -85.69 165.79 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.851 0.358 . . . . 70.04 111.652 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 0.0 OUTLIER -92.63 20.18 6.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.402 0.62 . . . . 63.41 110.524 -179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.88 33.25 3.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.46 -0.941 . . . . 71.52 108.46 178.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -120.57 144.57 38.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.473 -0.785 . . . . 74.42 110.516 -178.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 9.4 Cg_exo -72.71 159.62 48.17 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.86 2.373 . . . . 52.43 111.862 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.472 ' O ' HG23 ' A' ' 54' ' ' VAL . 92.2 m-85 -61.04 -42.87 99.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 60.45 111.58 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.43 -29.42 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.292 -0.413 . . . . 71.25 111.708 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -66.04 -41.9 90.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.985 -0.376 . . . . 73.12 109.985 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -64.03 -37.57 87.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.755 -0.657 . . . . 63.54 110.409 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' TYR . 48.6 t -64.87 -37.18 79.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.107 -0.497 . . . . 61.31 110.485 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.03 -45.21 67.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.279 -0.419 . . . . 73.43 111.692 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.57 -21.02 63.64 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.784 -0.366 . . . . 75.03 111.349 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.416 ' HG3' ' HG2' ' A' ' 68' ' ' ARG . 51.1 ttm -80.57 -41.03 24.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.266 0.555 . . . . 74.24 109.783 171.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -59.9 -41.39 91.54 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.29 -0.868 . . . . 72.21 111.87 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -65.22 -20.75 66.58 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.777 0.322 . . . . 64.22 111.611 -178.438 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 41' ' ' GLU . 77.8 mt -84.33 -40.7 17.6 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.08 0.467 . . . . 74.43 110.908 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.4 t -78.36 -24.42 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.946 -0.57 . . . . 64.22 111.734 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.481 ' OE1' ' HA ' ' A' ' 59' ' ' LYS . 11.3 pt-20 -62.52 -14.37 41.12 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.769 0.655 . . . . 74.43 112.769 -174.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.25 -29.33 70.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.035 0.445 . . . . 74.44 110.47 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -174.85 -123.1 0.72 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.61 -0.996 . . . . 73.43 110.61 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 101' ' ' ASN . 40.1 pttt -118.73 82.97 1.94 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.689 0.757 . . . . 74.32 109.969 171.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 106' ' ' ARG . 9.2 tp10 -101.26 145.89 28.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.061 -0.972 . . . . 63.22 110.851 -174.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.1 m -94.96 126.56 40.38 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.846 -0.798 . . . . 72.53 108.846 176.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -126.5 106.68 9.62 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.241 -0.583 . . . . 72.11 110.677 -174.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.684 ' HB2' ' CZ ' ' A' ' 94' ' ' PHE . 5.5 p90 -105.22 126.63 52.3 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.101 -0.5 . . . . 75.5 110.342 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -136.2 154.49 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.108 -0.496 . . . . 73.24 111.368 -175.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -109.07 128.48 55.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.779 -0.646 . . . . 73.14 109.913 177.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.5 p -129.3 122.28 55.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.97 0.414 . . . . 73.13 111.159 -178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.73 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 13.5 t70 -93.99 115.0 27.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.831 -0.622 . . . . 73.21 109.524 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.31 134.9 64.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 60.33 110.65 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.781 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.1 OUTLIER -94.58 129.67 41.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.062 -0.517 . . . . 61.11 109.901 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.54 HG11 ' HG3' ' A' ' 147' ' ' MET . 28.0 t -119.3 123.73 71.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.006 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 2.5 t -87.13 112.06 21.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.205 0.526 . . . . 62.2 110.67 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 87' ' ' SER . 1.4 t -141.63 162.44 20.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.977 -0.556 . . . . 63.33 110.148 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -90.34 106.39 18.46 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.748 -0.834 . . . . 62.32 108.748 172.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 80' ' ' ARG . 9.5 mmm180 -111.34 168.35 9.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.762 0.315 . . . . 71.22 110.517 -175.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -61.27 114.97 3.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 63.34 110.368 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.19 -30.72 3.14 Favored Glycine 0 N--CA 1.445 -0.753 0 CA-C-N 115.757 -0.656 . . . . 54.33 111.934 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.8 134.53 19.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 71.42 111.04 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.62 2.72 43.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.824 -0.626 . . . . 51.11 110.762 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -105.8 -171.66 23.56 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.78 -0.724 . . . . 71.34 112.199 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 p -67.91 94.3 0.46 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.273 0.558 . . . . 63.53 111.209 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.539 ' HB2' ' O ' ' A' ' 78' ' ' VAL . 49.4 m -90.44 105.04 17.55 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.836 -0.62 . . . . 62.12 110.175 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.581 HG22 ' HB2' ' A' ' 75' ' ' GLU . 4.7 m -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.09 0.471 . . . . 73.31 110.33 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.535 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 6.4 mp -111.55 122.06 46.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.781 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 4.7 p-10 -87.97 122.95 32.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.203 0.525 . . . . 74.12 109.751 177.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 90' ' ' ASN . 5.9 mptp? -121.42 124.15 43.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.723 -0.671 . . . . 72.51 110.329 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.73 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 3.5 p -82.94 115.17 24.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 121.557 0.694 . . . . 72.52 110.476 177.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.706 HD11 HG23 ' A' ' 129' ' ' VAL . 17.2 tt -111.92 146.28 16.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 64.14 110.132 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.684 ' CZ ' ' HB2' ' A' ' 69' ' ' TYR . 48.3 t80 -102.7 113.56 27.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.383 -0.371 . . . . 71.24 110.487 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.6 t -104.92 94.77 3.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.089 0.471 . . . . 73.22 110.235 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.532 ' HA ' ' HA ' ' A' ' 69' ' ' TYR . 3.0 pt20 -86.12 109.58 18.95 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.015 -0.539 . . . . 65.32 111.231 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -85.73 123.68 31.39 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.421 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 45.4 t -165.38 107.89 0.77 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.131 -0.486 . . . . 74.21 110.392 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -83.81 177.06 6.42 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.81 2.34 . . . . 74.3 112.844 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -76.38 -17.65 59.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.385 0.612 . . . . 75.02 110.162 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.493 ' O ' ' HD2' ' A' ' 65' ' ' LYS . 26.5 t-20 -82.37 -10.6 59.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.126 -0.943 . . . . 65.05 110.91 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -61.53 149.01 85.29 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.825 -0.625 . . . . 62.25 111.636 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.478 ' HG3' ' HE3' ' A' ' 65' ' ' LYS . 19.8 Cg_exo -65.69 139.67 58.88 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.656 2.237 . . . . 64.41 111.785 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.65 -50.29 41.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 75.34 111.474 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -59.4 -40.29 86.16 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.193 0.52 . . . . 75.44 110.874 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 40.9 ttm180 -74.65 -43.37 55.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 74.42 111.19 -174.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 110' ' ' TYR . 5.2 ppt_? -74.45 -22.56 59.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 72.43 110.399 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 54.4 tpp -68.17 -42.18 80.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.632 -0.507 . . . . 63.14 109.632 177.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 98.8 mt -65.9 -41.07 91.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.888 -0.596 . . . . 71.33 110.174 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.407 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 0.1 OUTLIER -54.27 -45.05 72.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.553 -0.749 . . . . 74.33 110.688 175.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.4 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -64.59 -45.68 85.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.303 -0.408 . . . . 74.12 110.954 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 70.0 m -61.14 -37.92 84.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.205 0.446 . . . . 71.52 112.205 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 78.0 p -70.38 -18.02 63.04 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.657 0.243 . . . . 70.44 111.657 -176.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.476 ' O ' ' HB3' ' A' ' 118' ' ' LYS . 97.2 t -58.76 -53.89 41.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.674 0.273 . . . . 32.03 111.145 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.401 ' HD2' ' C ' ' A' ' 115' ' ' ARG . 5.3 ppt_? -69.45 -21.32 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.899 0.381 . . . . 75.52 110.404 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.55 -58.83 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.189 -0.459 . . . . 74.12 112.016 -173.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.524 ' HB3' HD13 ' A' ' 38' ' ' ILE . 4.5 pp -84.55 -34.99 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.628 -0.429 . . . . 75.12 112.077 -172.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.523 ' HG2' ' HB2' ' A' ' 123' ' ' LEU . 12.5 tmtt? -68.56 -40.21 80.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.874 0.369 . . . . 72.43 110.819 -175.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.423 ' HA ' ' OE2' ' A' ' 124' ' ' GLU . . . -77.43 -40.06 44.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.438 -0.346 . . . . 64.24 111.189 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 31.2 t -70.09 -33.39 71.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 52.34 111.482 -175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.526 ' HG ' ' HD3' ' A' ' 12' ' ' LYS . 10.9 mp -88.64 -2.75 58.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.84 -0.344 . . . . 74.34 111.323 -173.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 82.33 49.7 5.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.075 -0.583 . . . . 61.23 113.349 175.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.752 ' HA ' HD23 ' A' ' 126' ' ' LEU . 6.7 mp -107.5 20.97 18.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.85 0.357 . . . . 73.45 110.387 176.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 119' ' ' ALA . 30.5 mm-40 -59.49 -40.28 86.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.079 -0.51 . . . . 72.51 111.922 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.9 m -102.88 19.03 20.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.968 0.413 . . . . 62.23 110.96 -177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.6 mm? -108.43 -168.2 1.33 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.187 -0.46 . . . . 63.04 110.523 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.496 ' HB2' HG13 ' A' ' 93' ' ' ILE . 27.5 m-85 -115.09 149.37 37.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.531 -0.304 . . . . 72.14 110.639 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -134.1 130.34 37.26 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.133 -0.485 . . . . 74.51 109.933 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.706 HG23 HD11 ' A' ' 93' ' ' ILE . 86.5 t -126.89 111.57 26.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.099 0.476 . . . . 74.44 110.448 178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.513 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 8.8 pm0 -86.5 118.39 25.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.871 -0.604 . . . . 72.5 109.983 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB3' ' A' ' 136' ' ' ASP . . . -113.6 133.74 55.11 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.008 -176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.25 -52.28 7.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.425 . . . . 74.22 111.455 178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 136' ' ' ASP . 0.9 OUTLIER -112.58 162.64 15.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.712 0.291 . . . . 74.22 110.613 178.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 ppp? -66.28 -15.14 62.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.389 -0.369 . . . . 70.23 111.231 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.413 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 9.9 m -83.09 -15.58 50.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.171 -0.468 . . . . 73.14 110.651 179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.419 ' HB2' ' OE2' ' A' ' 133' ' ' GLU . 34.5 t70 -83.11 -26.59 30.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.259 -0.428 . . . . 71.32 110.532 -177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 4.3 pp -82.04 -1.04 47.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.288 -0.415 . . . . 64.03 110.789 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.83 145.68 28.75 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.816 -0.629 . . . . 72.22 110.679 173.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -51.82 -23.98 5.45 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.417 0.895 . . . . 75.0 113.417 -172.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 135' ' ' SER . 0.2 OUTLIER -51.7 -32.43 30.08 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 111.559 0.207 . . . . 65.22 111.559 -177.135 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 17.9 m -108.75 -60.23 1.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.569 0.223 . . . . 73.45 110.982 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.488 HG22 HG11 ' A' ' 129' ' ' VAL . 91.4 t -55.82 -54.21 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.18 -0.464 . . . . 61.22 112.013 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 5.2 tmmm? -66.3 -40.23 89.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.618 -0.265 . . . . 75.31 110.602 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 m -65.25 -37.47 87.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.495 -0.32 . . . . 73.13 111.479 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.9 -58.54 7.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.177 0.513 . . . . 64.5 110.487 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.28 -20.48 64.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.608 -0.724 . . . . 70.13 111.405 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.54 ' HG3' HG11 ' A' ' 76' ' ' VAL . 53.7 ttp -73.84 -34.0 64.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 73.24 110.373 177.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 15.3 m -84.25 -47.84 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 53.53 110.047 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -79.93 4.74 15.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.595 -0.729 . . . . 53.5 111.196 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 89' ' ' LEU . 44.2 tt0 -50.72 -44.31 58.15 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.687 0.795 . . . . 73.25 111.605 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.7 tpt85 -148.17 84.22 1.51 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.422 -0.808 . . . . 75.13 109.806 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.249 1.034 0 CA-C-N 115.415 -0.811 . . . . 70.35 111.005 174.78 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.703 ' HG2' ' HB1' ' A' ' 111' ' ' ALA . 85.7 mtp . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 109.79 -0.448 . . . . 70.41 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.18 -73.89 0.12 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.4 -0.364 . . . . 72.21 111.288 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HB3' ' A' ' 112' ' ' SER . 21.4 p -149.7 -159.14 0.99 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.066 -0.515 . . . . 53.11 110.547 -178.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.89 -34.79 5.4 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 110.929 -0.868 . . . . 54.22 110.929 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.769 HG13 ' HB ' ' A' ' 36' ' ' THR . 60.1 t -98.84 122.02 50.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.283 -0.459 . . . . 74.55 109.787 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 0.5 OUTLIER -84.52 151.8 24.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.114 0.483 . . . . 61.55 110.477 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.59 HG12 HD12 ' A' ' 38' ' ' ILE . 26.0 m -102.01 143.06 15.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 65.02 110.715 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 t70 -99.07 120.19 58.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.375 -0.602 . . . . 73.14 109.375 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' ASP . 77.9 Cg_exo -51.96 -19.03 7.75 Favored 'Trans proline' 0 N--CA 1.477 0.512 0 C-N-CA 123.789 2.993 . . . . 64.32 114.39 -173.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.6 m -59.95 -33.87 72.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.689 0.28 . . . . 74.1 111.321 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 29.5 p -67.73 -38.14 83.16 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.035 0.445 . . . . 62.13 110.516 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -73.08 -33.68 65.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 73.14 110.154 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -56.97 -43.37 81.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 41.11 110.217 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.0 -29.15 55.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.661 -0.699 . . . . 51.31 110.709 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.43 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 92.5 t80 -64.69 -39.88 94.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.069 -0.514 . . . . 65.22 110.92 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -56.63 -38.17 71.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.176 0.512 . . . . 73.53 110.211 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.63 -42.71 70.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.751 -0.659 . . . . 64.1 111.342 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' ' 22' ' ' HIS . 4.1 pp -77.8 -32.46 52.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.701 -0.4 . . . . 73.4 111.981 -174.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -95.95 -59.6 1.82 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.702 -0.399 . . . . 72.31 111.659 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.29 -41.51 76.7 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.032 0.444 . . . . 71.15 110.873 -172.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -96.81 -20.23 18.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.165 -0.471 . . . . 73.35 110.115 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.657 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.8 t-160 58.01 34.44 24.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.957 -1.019 . . . . 73.42 110.4 -175.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 6.1 tp60 -73.34 -19.37 61.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.184 -0.916 . . . . 74.34 110.267 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.541 ' H ' ' HA ' ' A' ' 18' ' ' LEU . 74.8 m-70 -136.33 161.57 35.43 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.919 -1.141 . . . . 62.2 107.919 175.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.589 ' OG ' ' HA ' ' A' ' 46' ' ' LYS . 44.0 m -115.67 -40.54 3.35 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 120.572 -0.451 . . . . 64.41 111.387 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 42.6 m-85 -116.52 145.81 43.06 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.079 -0.341 . . . . 74.14 110.079 -176.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.3 tt -144.83 156.49 14.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 120.791 -0.364 . . . . 72.05 110.34 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.485 HG12 ' NH2' ' A' ' 68' ' ' ARG . 49.2 mt -123.73 120.61 60.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.303 -0.408 . . . . 55.4 110.472 -179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 44.9 m-85 -106.38 141.76 37.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.131 -0.486 . . . . 70.04 110.47 177.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -132.23 155.62 47.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.104 -0.498 . . . . 73.15 109.945 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 109' ' ' LEU . 7.9 tt -93.92 108.83 21.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.549 0.69 . . . . 75.02 109.748 175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -125.22 -167.3 1.66 Allowed 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.773 -0.825 . . . . 74.52 108.773 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.808 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 5.4 tppp? 69.47 130.72 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.299 0.571 . . . . 72.31 111.195 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -69.2 -11.5 60.85 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.12 -0.363 . . . . 73.21 111.138 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.808 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 33.2 t70 -108.24 20.89 18.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 71.25 109.678 175.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.769 ' HB ' HG13 ' A' ' 5' ' ' VAL . 82.7 p 59.69 108.84 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.511 1.124 . . . . 74.02 112.964 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -147.99 121.85 9.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.734 -0.666 . . . . 73.52 110.641 175.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.597 HD13 HD23 ' A' ' 117' ' ' LEU . 66.1 mt -78.23 122.16 32.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.426 -0.583 . . . . 74.14 109.426 174.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.66 161.93 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 116.427 -0.351 . . . . 54.45 110.952 -173.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.3 t -78.74 127.69 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.24 -0.436 . . . . 72.03 111.011 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.09 -44.57 5.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.04 0.447 . . . . 73.42 110.299 176.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 7.3 tmtt? -148.56 145.18 27.73 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.821 -0.437 . . . . 65.34 109.821 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.479 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 13.6 p -128.54 142.94 42.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.237 0.542 . . . . 73.21 110.438 176.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.68 132.58 11.05 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.848 -0.615 . . . . 74.42 111.877 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -72.29 160.52 32.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.005 0.431 . . . . 62.43 111.606 -177.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.628 ' HD3' ' H ' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.32 -13.82 62.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 63.4 111.035 -178.75 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -98.86 11.11 39.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 70.41 110.397 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.49 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -103.65 135.47 19.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.044 -0.526 . . . . 53.43 110.636 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 7.7 Cg_exo -74.15 178.35 7.05 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.954 2.436 . . . . 72.21 111.965 175.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.444 ' O ' HG23 ' A' ' 54' ' ' VAL . 50.8 p90 -63.6 -23.58 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 64.32 111.374 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.27 -31.83 73.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.303 -0.408 . . . . 74.51 111.44 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -38.11 89.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.517 0.675 . . . . 52.33 109.739 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 26' ' ' TYR . 83.9 t80 -76.82 -33.01 57.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.228 -0.896 . . . . 72.03 111.27 -177.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 50' ' ' TYR . 89.8 t -74.9 -50.65 24.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 72.32 111.885 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.33 -44.03 92.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.228 0.455 . . . . 74.23 112.228 -173.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 22.9 mm-40 -59.76 -28.93 67.81 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.065 0.46 . . . . 74.31 110.948 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.406 ' HG3' ' HD3' ' A' ' 68' ' ' ARG . 40.2 ttp -85.32 -44.66 12.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.76 -0.654 . . . . 75.32 110.943 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -60.35 -48.61 80.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.764 -0.653 . . . . 64.51 112.085 -177.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 62.9 pttt -56.58 -20.45 20.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.232 0.539 . . . . 64.03 110.939 -177.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.9 mt -83.96 -50.57 7.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.639 -0.709 . . . . 74.23 110.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 23.4 t -65.58 -20.52 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 63.13 110.015 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.59 -26.99 68.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.811 -0.631 . . . . 75.13 110.943 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -78.29 -12.03 59.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.987 0.422 . . . . 72.35 111.122 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.0 -125.15 1.58 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.973 -0.632 . . . . 60.4 112.007 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -119.9 90.99 3.44 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.24 0.543 . . . . 74.4 110.707 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -109.98 156.02 21.02 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.403 -0.817 . . . . 44.24 110.179 -176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 p -122.12 141.7 51.15 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.358 -0.383 . . . . 55.02 110.437 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.485 ' NH2' HG12 ' A' ' 28' ' ' ILE . 0.9 OUTLIER -149.62 148.66 29.59 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.511 -0.313 . . . . 64.31 110.231 -179.342 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.3 153.52 18.89 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.975 -0.38 . . . . 62.51 109.975 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -130.56 131.38 45.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.099 0.476 . . . . 73.04 112.083 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -127.18 109.91 12.33 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.031 -0.986 . . . . 52.45 108.799 171.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 2.4 p -123.34 130.58 74.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 120.949 0.404 . . . . 65.52 111.266 -176.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.449 ' OD2' ' HB ' ' A' ' 92' ' ' VAL . 10.9 t70 -115.67 109.95 18.46 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.482 -0.781 . . . . 75.55 109.055 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.88 144.8 23.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.81 0.338 . . . . 51.14 110.974 -174.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.808 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.6 OUTLIER -86.09 114.97 23.37 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.301 0.572 . . . . 64.42 110.516 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.14 134.11 47.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.369 -0.604 . . . . 64.44 109.369 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' SER . 11.2 t -92.8 129.06 38.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.478 0.656 . . . . 73.23 111.328 -175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.438 ' HB ' ' HG2' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -145.71 -174.9 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 N-CA-C 108.606 -0.887 . . . . 73.4 108.606 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' H ' HG12 ' A' ' 78' ' ' VAL . 33.3 tt0 -111.15 105.85 14.69 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.901 -0.777 . . . . 70.11 108.901 169.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 78' ' ' VAL . 28.3 mmm180 -138.04 -165.37 1.78 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.332 . . . . 74.43 110.692 -173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -67.73 126.3 28.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.543 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 132.64 -36.12 2.22 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 111.049 -0.82 . . . . 72.52 111.049 -178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.48 147.25 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.513 -0.343 . . . . 55.3 110.183 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -79.67 8.11 7.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.137 0.494 . . . . 72.14 110.586 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.46 -125.61 1.68 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 115.73 -0.668 . . . . 70.01 111.615 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 1.9 m -69.54 112.68 6.21 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 73.21 111.896 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 77' ' ' THR . 14.7 m -106.98 135.86 47.84 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.174 -0.921 . . . . 74.45 109.748 178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.4 p -121.97 110.54 15.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.835 0.35 . . . . 55.43 110.535 177.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.35 123.47 31.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 73.44 110.827 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.808 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -76.0 124.86 28.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.328 0.585 . . . . 72.42 110.284 176.354 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.559 ' HG2' ' HG2' ' A' ' 150' ' ' GLN . 5.1 mptp? -127.96 143.77 51.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.925 -0.58 . . . . 64.42 111.036 -177.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 72' ' ' VAL . 13.6 p -111.84 139.79 34.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 61.34 109.347 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.461 HD12 ' HB3' ' A' ' 146' ' ' LEU . 15.1 tt -139.38 153.11 23.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.805 0.336 . . . . 64.42 110.58 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.64 ' HB3' ' HG2' ' A' ' 128' ' ' GLN . 0.1 OUTLIER -101.38 120.97 41.08 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.538 -0.541 . . . . 65.24 109.538 175.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 41.9 t -124.74 110.74 25.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.165 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 130' ' ' GLN . 15.0 pt20 -83.66 107.34 16.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.061 0.458 . . . . 54.31 110.683 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.484 ' HE1' ' HB3' ' A' ' 137' ' ' LEU . 74.4 m-85 -87.7 105.68 17.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.233 -0.44 . . . . 73.4 110.478 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 42.8 t -172.06 120.01 0.45 Allowed Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.697 -0.683 . . . . 74.44 110.289 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -77.08 162.42 31.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.104 1.869 . . . . 74.11 111.353 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.03 -5.34 45.93 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.031 0.443 . . . . 74.12 110.754 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.15 -2.04 46.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.914 -0.585 . . . . 74.13 110.694 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -70.39 140.38 87.49 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 75.21 110.676 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 35.4 Cg_exo -57.26 141.51 94.59 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.734 2.289 . . . . 75.54 112.051 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.3 t -52.01 -39.78 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.252 0.834 . . . . 73.44 113.252 -171.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -62.95 -56.21 19.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.881 -0.327 . . . . 74.41 111.017 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -62.42 -35.58 79.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.361 0.6 . . . . 65.32 109.964 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -59.48 -49.79 76.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.252 -0.885 . . . . 74.3 111.023 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 47.1 tpp -64.02 -42.59 97.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.071 -0.513 . . . . 65.43 111.263 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.563 ' HB3' HD13 ' A' ' 31' ' ' ILE . 99.1 mt -60.16 -45.58 92.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 71.23 110.465 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 96' ' ' GLN . 52.8 t80 -63.44 -45.51 90.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.493 -0.776 . . . . 74.02 110.559 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.703 ' HB1' ' HG2' ' A' ' 1' ' ' MET . . . -62.12 -37.49 85.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 75.43 111.83 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 3' ' ' SER . 42.4 m -68.48 -22.58 64.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.335 -0.393 . . . . 64.41 111.668 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.569 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 31.5 m -80.27 -25.88 39.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.645 -0.252 . . . . 62.34 111.529 -176.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 85.6 t -52.0 -56.12 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 112.837 0.68 . . . . 74.54 112.837 -172.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -68.73 -32.15 71.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.829 0.347 . . . . 74.23 110.947 -174.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -68.44 -51.79 39.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.21 -0.45 . . . . 63.42 111.927 -176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.597 HD23 HD13 ' A' ' 38' ' ' ILE . 2.1 pp -70.6 -23.89 62.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.61 0.596 . . . . 74.12 112.61 -173.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 94' ' ' PHE . 9.8 mtpt -61.98 -52.04 65.62 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.731 -0.388 . . . . 72.02 110.839 178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.76 62.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.039 -0.528 . . . . 74.3 111.258 -176.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 t -70.96 -31.58 68.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.453 -0.34 . . . . 65.11 111.408 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.589 HD22 ' HZ ' ' A' ' 94' ' ' PHE . 11.0 mp -94.79 -18.84 20.86 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.536 -0.466 . . . . 71.05 111.146 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 96.24 18.16 32.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.263 -0.97 . . . . 54.05 113.342 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.66 25.98 2.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 73.12 110.252 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -62.77 -30.44 71.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.757 -0.656 . . . . 74.34 110.824 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.0 m -91.92 1.56 57.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.428 -0.351 . . . . 65.24 111.041 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.8 mm? -111.62 164.28 13.18 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.924 0.392 . . . . 73.32 110.896 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -79.6 151.24 30.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.791 -0.64 . . . . 75.51 111.848 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.64 ' HG2' ' HB3' ' A' ' 94' ' ' PHE . 0.1 OUTLIER -127.76 117.05 21.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.967 -1.123 . . . . 73.44 107.967 176.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.7 t -124.05 140.35 47.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.763 0.316 . . . . 74.33 110.553 -174.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.53 ' HA ' ' HG3' ' A' ' 96' ' ' GLN . 16.8 pm0 -89.27 137.93 31.88 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.049 0.452 . . . . 72.2 110.581 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -120.94 130.14 53.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.175 -0.676 . . . . 51.55 109.175 174.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.4 m -84.59 -81.76 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.342 -0.39 . . . . 74.52 111.465 -173.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.38 -168.24 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.708 0.29 . . . . 74.41 111.114 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.534 ' O ' ' HG ' ' A' ' 137' ' ' LEU . 72.6 mtm -65.98 -32.52 74.05 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.597 0.591 . . . . 62.44 112.597 -173.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 23.2 t -73.04 -25.1 60.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.182 0.515 . . . . 72.34 110.091 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -85.01 -20.14 30.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.924 -0.58 . . . . 73.44 111.776 -173.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 134' ' ' MET . 4.4 pp -80.58 -0.04 36.06 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.904 0.383 . . . . 63.54 110.971 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -57.85 145.37 35.52 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.662 -0.699 . . . . 53.33 110.882 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.517 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 13.7 pt-20 -52.19 -22.83 4.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.626 -0.715 . . . . 71.35 112.192 -178.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.53 -36.93 2.24 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.478 0.486 . . . . 73.14 112.064 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 54.5 m -109.3 -60.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.659 0.266 . . . . 43.03 111.111 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.5 t -56.51 -53.73 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.054 -0.521 . . . . 54.12 112.367 -171.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.517 ' CB ' ' HB2' ' A' ' 139' ' ' GLU . 2.7 tmmm? -64.67 -46.82 80.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 61.22 110.444 -175.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 44.1 m -66.58 -32.47 73.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 75.14 112.124 -175.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.58 -62.67 1.31 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.056 0.455 . . . . 65.24 110.772 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 93' ' ' ILE . 4.5 pp -67.5 -21.35 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 71.21 111.652 -175.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 57.5 ttp -64.64 -43.42 93.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 75.31 110.556 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 30.0 t -85.35 -33.92 21.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.107 -0.497 . . . . 64.23 110.506 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -86.39 13.91 7.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.242 -0.435 . . . . 75.34 111.641 -175.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.559 ' HG2' ' HG2' ' A' ' 91' ' ' LYS . 37.6 mt-30 -51.99 -48.57 64.37 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.635 -0.257 . . . . 54.31 111.413 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.617 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -152.79 114.09 4.22 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.526 0.679 . . . . 73.23 109.852 173.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 54.2 mt . . . . . 0 C--O 1.249 1.063 0 CA-C-N 115.344 -0.844 . . . . 54.15 109.596 -177.782 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.592 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 90.0 mtp . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 109.994 -0.372 . . . . 74.23 109.994 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.71 -155.83 0.47 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.242 -0.435 . . . . 74.32 110.225 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.2 m -137.79 37.36 2.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.393 0.616 . . . . 71.4 110.02 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -94.57 11.25 70.3 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.77 -0.65 . . . . 45.13 112.123 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.47 134.38 66.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.269 -0.641 . . . . 75.32 109.269 178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -100.06 153.67 19.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.355 0.597 . . . . 73.21 111.574 -176.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.6 m -85.25 143.01 12.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.158 -0.928 . . . . 71.35 110.293 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -97.72 135.04 21.75 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-O 120.711 0.291 . . . . 73.22 110.339 -178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.43 -27.09 82.05 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.674 2.25 . . . . 70.44 113.386 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.95 -40.29 63.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.721 0.296 . . . . 62.51 110.986 -175.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.528 ' HB2' ' HE1' ' A' ' 29' ' ' PHE . 26.5 p -76.02 -31.03 58.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.081 0.467 . . . . 72.52 109.943 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -70.0 -45.51 67.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.69 -0.686 . . . . 75.23 110.549 176.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 24.3 t-20 -64.1 -36.24 83.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.087 0.47 . . . . 63.1 110.261 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.35 65.3 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.023 -0.535 . . . . 73.5 110.128 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.643 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 72.5 t80 -76.69 -41.41 45.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.524 -0.762 . . . . 73.42 110.131 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -55.25 -37.74 67.63 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.034 0.445 . . . . 72.11 110.196 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 13' ' ' ASN . 96.4 mt -55.37 -43.73 75.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 74.54 111.128 177.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.833 ' HB3' ' HB2' ' A' ' 24' ' ' HIS . 4.3 pp -84.73 -26.18 27.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.69 0.281 . . . . 73.42 111.618 -179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -77.84 -38.19 46.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.709 0.29 . . . . 73.41 111.17 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -96.0 -57.99 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.663 0.268 . . . . 61.2 111.662 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -87.63 -23.61 24.2 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.377 0.608 . . . . 73.53 110.379 -176.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.56 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 9.2 t-80 64.26 42.3 5.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.701 -1.136 . . . . 62.0 109.758 -172.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -67.44 -19.51 65.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.843 -1.071 . . . . 71.53 110.35 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.833 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 33.2 m170 -129.67 161.92 29.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.782 -0.645 . . . . 73.13 109.37 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.3 m -101.87 -56.21 2.33 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.962 0.411 . . . . 74.01 110.199 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.651 ' HE1' ' HE3' ' A' ' 42' ' ' LYS . 21.3 p90 -131.38 153.5 49.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.951 0.405 . . . . 74.11 111.016 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.61 HD11 HG22 ' A' ' 40' ' ' VAL . 13.5 tt -143.55 137.85 25.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.895 -0.593 . . . . 72.23 110.423 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.7 mt -105.21 133.73 48.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.135 -0.484 . . . . 74.42 110.204 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.534 ' HB3' HG22 ' A' ' 38' ' ' ILE . 72.5 m-85 -112.86 154.39 26.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.442 . . . . 70.11 110.715 -178.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.636 ' HB3' ' HD2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -148.63 147.88 29.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.323 -0.399 . . . . 62.11 110.571 172.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 tt -88.42 125.73 41.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 62.33 110.234 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 2.1 t70 -147.74 -176.98 5.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.459 -0.337 . . . . 71.24 110.368 -178.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.6 pttp 55.22 148.32 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.731 1.612 . . . . 70.11 113.271 -175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -67.99 -16.43 64.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.269 -0.878 . . . . 72.22 110.973 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.82 -9.49 58.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.682 -0.69 . . . . 62.52 110.397 173.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.5 p 54.2 86.11 0.05 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.301 1.04 . . . . 64.31 112.739 177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.497 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . . . -143.55 156.58 44.64 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.492 -0.776 . . . . 43.51 110.248 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.786 HD13 HD23 ' A' ' 117' ' ' LEU . 20.0 mt -93.95 121.89 44.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.814 -0.63 . . . . 73.14 109.971 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -126.03 163.28 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.627 0.251 . . . . 73.24 110.653 -175.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.61 HG22 HD11 ' A' ' 27' ' ' ILE . 47.2 t -68.65 127.35 30.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 122.737 0.415 . . . . 70.35 111.412 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -94.17 -47.65 6.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.486 -0.561 . . . . 70.15 109.486 173.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.817 ' HE2' ' HG3' ' A' ' 56' ' ' GLU . 6.8 tmtm? -156.74 129.82 7.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.745 -0.661 . . . . 55.34 109.523 -177.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.1 p -112.86 151.73 14.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.817 -0.438 . . . . 72.34 109.817 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -115.25 141.04 16.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.875 -0.678 . . . . 20.12 111.71 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.437 ' OE2' ' HG2' ' A' ' 46' ' ' LYS . 0.5 OUTLIER -66.58 165.26 15.01 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.542 -0.54 . . . . 61.12 109.542 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HG2' ' OE2' ' A' ' 45' ' ' GLU . 24.0 pttm -64.37 -12.45 42.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 74.13 111.256 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -115.45 19.44 15.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.443 . . . . 74.04 110.503 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -68.17 137.72 91.87 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 70.32 111.243 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 1.6 Cg_endo -84.0 163.6 13.61 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.307 2.671 . . . . 74.25 112.084 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -67.66 -35.96 79.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 61.3 110.814 178.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -52.61 -48.13 66.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.024 -0.535 . . . . 73.01 111.925 -178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.36 -46.02 91.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.69 0.281 . . . . 74.24 110.66 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -57.09 -43.83 82.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.775 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.3 t -66.48 -49.56 74.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 61.1 110.898 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 36.5 mt-10 -65.64 -33.8 76.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.032 0.382 . . . . 70.32 112.032 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.817 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 18.5 mm-40 -61.79 -38.12 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.903 0.382 . . . . 74.32 110.974 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -78.93 -38.22 37.78 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.552 -0.536 . . . . 75.3 109.552 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 1.2 tmtm? -56.42 -49.27 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.218 -0.901 . . . . 74.41 111.517 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 63.4 pttt -67.44 -22.61 65.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.687 0.279 . . . . 72.52 111.553 -174.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.11 -43.31 24.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 44.23 110.93 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 48.4 t -65.54 -23.78 33.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 64.03 110.81 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 58' ' ' LYS . 48.6 mt-10 -69.69 -16.9 63.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.101 -0.499 . . . . 74.15 111.16 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.72 -29.22 27.69 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.773 -0.455 . . . . 63.22 109.773 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.27 -85.43 0.32 Allowed Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.5 -0.857 . . . . 60.21 113.863 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -90.88 24.97 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.056 0.391 . . . . 62.31 112.056 -167.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -86.8 135.14 33.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.406 0.622 . . . . 74.03 111.752 -176.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' O ' ' HD3' ' A' ' 68' ' ' ARG . 3.4 p -142.79 146.28 34.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.098 -0.956 . . . . 62.43 109.28 176.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HD2' ' HB3' ' A' ' 30' ' ' LYS . 82.5 mmt-85 -144.2 150.34 37.83 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.214 -0.291 . . . . 71.12 110.214 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -100.8 127.08 47.38 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.661 -0.866 . . . . 73.42 108.661 175.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -119.38 138.55 53.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.203 0.525 . . . . 51.13 112.323 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.2 118.87 31.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.258 -0.883 . . . . 51.44 109.385 174.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.624 HG23 ' HB3' ' A' ' 26' ' ' TYR . 3.6 p -127.86 122.87 59.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.041 0.448 . . . . 72.24 111.744 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.844 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 9.3 t70 -111.11 126.22 54.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.628 -0.714 . . . . 61.21 109.449 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.45 128.32 15.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.108 -0.496 . . . . 72.13 109.706 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -86.79 105.09 16.75 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.709 0.766 . . . . 73.43 109.533 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.481 ' HB ' HE22 ' A' ' 150' ' ' GLN . 38.1 t -84.86 123.92 39.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.35 -0.841 . . . . 74.34 109.719 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 t -77.91 109.98 12.43 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.582 0.706 . . . . 62.52 110.802 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -139.67 152.9 22.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.7 -0.682 . . . . 63.23 109.614 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 57.2 tt0 -76.4 105.15 7.29 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.664 -0.865 . . . . 61.05 108.664 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.5 mmm-85 -130.71 174.1 10.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.06 -0.518 . . . . 63.24 109.874 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -58.62 142.29 49.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.858 0.361 . . . . 75.04 110.542 175.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 117.39 -39.71 2.56 Favored Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 111.248 -0.741 . . . . 73.1 111.248 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -140.16 162.79 34.4 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.723 -0.473 . . . . 60.33 109.723 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.1 6.02 46.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.582 0.23 . . . . 75.1 111.063 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.514 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . -145.01 -135.07 2.83 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.444 -0.884 . . . . 73.22 112.809 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.2 p -68.69 106.39 2.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 70.11 111.722 -175.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.2 t -109.4 123.59 49.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 71.21 109.706 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.0 p -101.47 110.62 22.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.319 -0.4 . . . . 62.03 110.808 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 150' ' ' GLN . 6.8 mp -105.76 115.09 29.65 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.825 0.345 . . . . 74.11 110.363 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.619 ' CG ' ' HB3' ' A' ' 75' ' ' GLU . 11.5 m120 -76.61 109.89 10.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 71.53 109.956 177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.501 ' HD3' ' HG2' ' A' ' 150' ' ' GLN . 3.3 mptp? -123.76 114.54 20.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 64.44 110.914 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 4.5 p -93.68 125.92 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.456 -0.793 . . . . 73.12 110.06 177.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.669 HD11 HG23 ' A' ' 129' ' ' VAL . 16.7 tt -120.72 155.22 24.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.771 -0.65 . . . . 72.35 110.149 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 118' ' ' LYS . 3.9 m-85 -100.75 122.97 44.28 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.34 -0.391 . . . . 72.34 110.011 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 t -110.61 105.28 18.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.172 0.511 . . . . 55.35 109.79 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -83.91 107.33 16.23 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.483 -0.78 . . . . 74.43 110.68 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 34.0 m-85 -89.4 97.13 11.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 75.52 110.318 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 9.9 p -130.65 109.77 15.95 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.818 -0.628 . . . . 73.23 110.315 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.48 137.77 28.55 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.542 2.161 . . . . 61.04 111.535 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -57.4 -40.8 79.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.089 -0.505 . . . . 71.43 112.043 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -99.07 25.2 6.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.132 0.491 . . . . 75.25 111.011 -174.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -74.72 141.72 76.16 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 116.496 -0.32 . . . . 50.21 111.756 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.685 ' O ' ' HG3' ' A' ' 107' ' ' ARG . 75.8 Cg_exo -51.69 139.27 48.77 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.594 2.863 . . . . 62.04 113.068 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 41.3 t -51.55 -62.58 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.31 -0.859 . . . . 54.22 113.208 -171.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' MET . 6.3 mpt_? -56.88 -45.01 82.83 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.32 112.075 -170.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -63.1 -53.73 49.05 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.878 -176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.685 ' HG3' ' O ' ' A' ' 103' ' ' PRO . 7.2 ppt_? -78.36 -20.13 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.48 0.548 . . . . 73.13 112.48 -175.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' O ' ' A' ' 105' ' ' ARG . 26.7 ptm -69.58 -36.0 75.87 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 120.045 -0.662 . . . . 73.15 109.731 175.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.9 mt -72.72 -44.06 62.18 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.771 -0.455 . . . . 73.1 109.771 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 107' ' ' ARG . 91.3 t80 -53.95 -48.55 70.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.215 -0.902 . . . . 74.33 110.909 177.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.33 -21.2 62.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.13 -0.486 . . . . 72.24 111.66 -178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 58.1 m -88.74 -16.07 33.16 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.825 0.306 . . . . 64.24 111.825 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.5 p -87.49 -9.82 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.785 -0.366 . . . . 71.13 111.011 176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.48 -48.25 85.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 115.996 -0.547 . . . . 74.41 112.021 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 115' ' ' ARG . 1.2 tmt_? -60.51 -34.93 74.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 73.53 111.05 -176.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -70.04 -57.79 4.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.25 -0.432 . . . . 71.23 111.347 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.786 HD23 HD13 ' A' ' 38' ' ' ILE . 3.8 pp -65.97 -31.34 72.19 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.919 0.34 . . . . 73.02 111.919 -174.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.59 ' N ' HD12 ' A' ' 117' ' ' LEU . 10.3 tmtt? -73.74 -41.17 62.89 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.902 0.382 . . . . 61.4 110.934 -175.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.27 -40.24 21.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.375 -0.375 . . . . 45.0 111.442 -177.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.1 t -67.04 -29.64 69.5 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.194 0.442 . . . . 44.54 112.194 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.2 mp -90.79 -0.1 57.61 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.363 -0.535 . . . . 64.53 111.467 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 83.09 21.85 58.32 Favored Glycine 0 CA--C 1.518 0.232 0 C-N-CA 120.931 -0.652 . . . . 43.55 114.093 171.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 126' ' ' LEU . 6.5 mp -96.71 26.41 4.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.336 0.568 . . . . 72.41 110.437 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.576 ' HA ' ' NZ ' ' A' ' 118' ' ' LYS . 5.1 mm-40 -53.61 -47.24 70.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.576 -0.738 . . . . 72.35 112.338 -178.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.2 m -90.5 13.34 16.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.617 0.246 . . . . 71.03 111.612 -177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 ' HG ' ' A' ' 123' ' ' LEU . 77.9 mt -105.65 -175.6 2.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.656 0.265 . . . . 71.11 110.782 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -110.6 151.6 27.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.935 0.398 . . . . 74.44 111.21 -170.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -133.19 137.43 46.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.982 -0.553 . . . . 71.14 110.188 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.669 HG23 HD11 ' A' ' 93' ' ' ILE . 59.8 t -123.8 135.08 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.439 . . . . 71.24 109.86 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -98.77 142.18 30.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.912 0.386 . . . . 71.03 110.638 178.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.532 ' HB1' ' HB2' ' A' ' 136' ' ' ASP . . . -144.68 154.45 42.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.874 -0.603 . . . . 72.41 109.92 -178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 70.6 m -108.44 -51.75 2.85 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.996 -0.282 . . . . 65.22 111.189 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -121.47 -175.25 3.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.154 0.502 . . . . 70.12 111.67 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.495 ' HA ' ' HG ' ' A' ' 137' ' ' LEU . 67.7 mtm -68.13 -30.14 69.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.65 -0.704 . . . . 74.12 111.988 -175.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.9 m -65.14 -21.55 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.176 0.512 . . . . 72.11 110.722 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.532 ' HB2' ' HB1' ' A' ' 131' ' ' ALA . 38.3 m-20 -83.81 -40.67 18.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.115 -0.493 . . . . 71.42 110.267 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 134' ' ' MET . 4.6 pp -84.21 -2.81 57.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.716 -0.675 . . . . 73.22 111.866 -173.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.542 ' HB3' ' CE ' ' A' ' 140' ' ' LYS . 17.9 t0 -57.98 137.35 56.87 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.934 0.397 . . . . 74.12 110.043 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.463 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.4 OUTLIER -58.12 -22.17 49.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.555 -0.748 . . . . 73.44 112.146 -173.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 138' ' ' ASP . 0.1 OUTLIER -51.91 -22.33 3.74 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.117 0.414 . . . . 75.04 112.117 177.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.0 m -115.63 -60.06 1.92 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.513 0.197 . . . . 61.21 110.974 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.41 -46.56 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.191 -0.458 . . . . 61.13 112.078 -172.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.467 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 3.9 tmmm? -58.93 -43.65 91.21 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.943 0.401 . . . . 74.23 110.709 -177.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 19.2 m -75.54 -33.26 60.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.244 -0.434 . . . . 65.43 111.09 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -67.37 -47.95 68.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.095 -0.502 . . . . 70.15 111.004 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.22 -23.47 62.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 74.32 110.417 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.42 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 14.7 tmm? -72.0 -40.62 68.38 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.38 -0.6 . . . . 64.23 109.38 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 35.5 t -63.64 -53.96 43.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.57 -0.741 . . . . 75.15 110.073 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -77.56 14.27 1.05 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.588 0.588 . . . . 74.44 112.588 -176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.501 ' HG2' ' HD3' ' A' ' 91' ' ' LYS . 47.5 mt-30 -55.73 -47.49 76.82 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.856 -0.424 . . . . 73.3 109.856 171.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 151' ' ' ARG . 0.0 OUTLIER -164.44 91.27 0.59 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.905 0.86 . . . . 72.31 110.47 172.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 26.0 mt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.169 -0.923 . . . . 74.34 109.144 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.863 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 63.7 mtm . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.567 0.222 . . . . 74.32 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.05 33.61 0.39 Allowed 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.587 0.588 . . . . 75.41 112.587 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 t 56.9 -145.21 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.503 -0.317 . . . . 52.22 110.402 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.33 -5.0 60.58 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.247 -0.741 . . . . 72.23 111.247 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.532 HG13 HG22 ' A' ' 36' ' ' THR . 19.1 t -125.38 143.4 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.331 -0.435 . . . . 71.12 109.93 -178.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 40.7 ttmt -115.58 154.03 30.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.376 -0.375 . . . . 72.24 110.526 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.453 HG11 ' HB3' ' A' ' 120' ' ' SER . 36.0 m -86.61 143.61 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.419 -0.355 . . . . 71.44 110.31 176.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -102.36 133.86 20.32 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 110.057 -0.349 . . . . 73.24 110.057 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.86 -19.72 40.65 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.318 2.679 . . . . 71.45 113.742 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.9 m -61.84 -44.27 97.18 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.99 0.424 . . . . 65.24 110.475 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 39' ' ' VAL . 46.5 m -66.47 -34.58 78.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.983 -0.553 . . . . 71.51 110.835 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -67.69 -41.28 83.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.178 -0.465 . . . . 74.33 110.745 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -56.41 -39.98 73.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.925 0.393 . . . . 51.12 110.375 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.64 65.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.808 -0.633 . . . . 71.03 110.59 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -61.37 -35.79 78.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.808 -0.633 . . . . 74.54 111.349 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -59.39 -36.04 75.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.73 0.3 . . . . 53.13 110.922 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.91 -46.3 58.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.298 -0.41 . . . . 71.15 109.933 176.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 tp -55.67 -40.96 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.786 -0.643 . . . . 63.11 111.21 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -62.97 -31.2 72.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.851 -0.613 . . . . 64.43 112.287 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -134.23 -73.84 0.48 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.384 -0.526 . . . . 71.23 112.368 -175.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -61.18 -33.4 73.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.737 -0.665 . . . . 74.03 112.369 -169.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 10.3 m80 67.82 44.62 1.55 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.388 -0.824 . . . . 64.12 111.23 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -53.36 -45.52 69.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.716 0.769 . . . . 52.21 109.305 171.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -142.05 151.71 42.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.867 -1.06 . . . . 72.03 108.367 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.5 t -113.91 -61.79 1.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.936 0.398 . . . . 60.23 111.333 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -74.67 119.07 18.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.135 -0.484 . . . . 72.54 109.889 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 40' ' ' VAL . 11.4 tt -141.96 119.71 8.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.826 0.822 . . . . 72.0 111.656 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 70' ' ' ALA . 60.1 mt -95.19 132.94 37.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.065 -0.97 . . . . 43.15 109.997 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -105.9 160.21 15.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.463 -0.335 . . . . 64.01 110.393 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.567 ' HE2' ' HB2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -144.11 152.5 41.03 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.835 0.35 . . . . 64.04 110.156 177.853 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.604 HD12 HG13 ' A' ' 38' ' ' ILE . 2.9 tp -96.55 143.55 12.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.886 -0.783 . . . . 70.3 108.886 176.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.725 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 46.2 t0 -162.75 179.65 7.5 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.203 -0.295 . . . . 64.32 110.203 -177.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 32' ' ' ASP . 19.7 ptmt 62.15 144.63 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.735 1.614 . . . . 65.42 113.2 175.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -65.56 -35.15 80.02 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.262 -0.881 . . . . 74.43 109.93 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.494 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 37.0 t70 -79.28 68.74 5.36 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.869 -1.16 . . . . 73.31 107.869 168.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.532 HG22 HG13 ' A' ' 5' ' ' VAL . 6.2 m -43.3 117.96 1.22 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.409 -1.269 . . . . 74.24 113.972 -164.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 33' ' ' LYS . . . -144.19 157.9 44.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.767 -1.106 . . . . 63.0 110.167 178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG13 HD12 ' A' ' 31' ' ' ILE . 4.1 mp -97.66 124.21 50.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 110.04 -0.356 . . . . 63.22 110.04 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.544 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 8.5 p -128.19 156.33 40.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.602 -0.272 . . . . 64.22 110.344 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.4 HG22 HD11 ' A' ' 27' ' ' ILE . 56.3 t -64.99 139.59 21.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.408 . . . . 62.23 111.097 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -112.37 -48.06 3.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 62.11 111.015 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 43' ' ' VAL . 10.1 tmtt? -144.95 127.52 16.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.452 -0.573 . . . . 72.24 109.452 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.446 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 12.5 p -118.54 131.06 72.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 109.374 -0.602 . . . . 75.14 109.374 174.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -101.97 -175.95 27.96 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 111.691 -0.563 . . . . 73.12 111.691 -178.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.55 ' OE1' ' HG2' ' A' ' 46' ' ' LYS . 4.6 mm-40 -70.81 172.92 8.0 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.578 0.704 . . . . 72.23 112.205 -176.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 16.6 pttm -85.71 -33.15 21.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.109 -0.951 . . . . 73.21 109.429 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -106.25 83.04 1.83 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.268 -0.878 . . . . 75.3 108.912 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.447 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -141.38 144.81 35.45 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.764 -0.653 . . . . 74.43 110.464 -178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 3.5 Cg_exo -81.18 162.88 20.14 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.731 2.287 . . . . 71.54 110.923 173.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -60.39 -19.27 55.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.682 0.277 . . . . 74.23 111.209 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 55' ' ' GLU . . . -49.52 -52.42 29.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 73.53 112.185 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -59.47 -38.39 80.69 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.113 0.482 . . . . 64.01 110.748 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' HE2' ' HH ' ' A' ' 97' ' ' TYR . 26.8 t80 -61.3 -36.05 79.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.368 -0.833 . . . . 73.42 110.388 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.88 -39.09 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.702 -0.681 . . . . 64.22 110.715 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.566 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 49.0 mt-10 -57.06 -49.67 75.14 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.359 -0.382 . . . . 74.13 111.657 -178.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 21.4 mm-40 -62.36 -25.36 67.87 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.213 0.53 . . . . 74.35 111.39 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.491 ' HA ' HH22 ' A' ' 68' ' ' ARG . 2.1 tmt? -86.06 -50.61 6.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.323 -0.398 . . . . 73.01 110.92 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 55' ' ' GLU . 0.1 OUTLIER -62.85 -30.47 71.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 75.25 112.015 -173.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 58' ' ' LYS . 63.5 pttt -76.19 -29.74 57.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.015 0.435 . . . . 73.15 110.791 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.4 HD23 ' CZ ' ' A' ' 68' ' ' ARG . 27.0 tp -86.8 -41.4 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.074 -0.512 . . . . 74.42 111.661 -177.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 57' ' ' MET . 96.2 t -67.91 -26.28 34.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.031 0.382 . . . . 45.33 112.031 -173.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -15.92 60.06 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.932 0.345 . . . . 64.41 111.932 -176.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -75.32 -15.04 60.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.939 0.4 . . . . 53.43 110.897 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 177.14 -130.78 1.69 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.169 -1.015 . . . . 54.13 112.742 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -119.12 22.67 11.75 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.166 0.507 . . . . 72.33 110.235 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -73.11 133.56 44.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 73.25 110.725 -177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.5 m -146.45 158.89 43.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.96 -0.563 . . . . 75.11 109.789 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' TYR . 0.0 OUTLIER -159.76 147.89 17.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.474 -0.33 . . . . 75.34 110.249 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.674 ' HB3' ' HA ' ' A' ' 96' ' ' GLN . 1.8 p90 -77.94 156.48 30.22 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.933 -0.576 . . . . 74.13 111.591 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB2' HG23 ' A' ' 28' ' ' ILE . . . -149.85 163.35 38.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.35 -0.386 . . . . 75.14 111.15 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.416 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -122.2 142.86 49.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.312 -0.404 . . . . 53.22 110.499 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.9 p -152.42 141.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.381 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.46 142.8 50.18 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.608 -0.515 . . . . 70.15 109.608 176.121 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.11 140.1 21.02 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 110.048 -0.353 . . . . 74.22 110.048 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.5 OUTLIER -89.03 106.07 18.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.417 0.627 . . . . 62.41 109.556 175.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HG22 ' A' ' 78' ' ' VAL . 15.3 t -91.46 127.26 43.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.784 -0.644 . . . . 60.42 109.495 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.668 ' OG1' ' HB ' ' A' ' 86' ' ' THR . 2.9 t -86.11 98.48 10.9 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.779 0.8 . . . . 70.03 110.901 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.415 HG21 ' HG2' ' A' ' 147' ' ' MET . 1.2 t -126.08 131.53 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.609 -0.723 . . . . 70.33 110.708 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 24.1 tt0 -66.76 106.23 1.8 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.002 -0.74 . . . . 64.04 109.002 174.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -126.15 -176.45 3.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.935 -0.575 . . . . 65.24 110.739 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.15 144.19 50.3 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.738 -0.665 . . . . 72.03 110.342 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.56 37.09 47.22 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.839 -0.696 . . . . 60.43 111.962 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.21 152.81 37.85 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.604 0.24 . . . . 33.04 110.707 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -89.21 14.78 10.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.277 0.561 . . . . 64.32 110.208 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 79' ' ' GLN . . . 157.68 -132.4 3.17 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.031 -0.828 . . . . 62.21 111.031 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.668 ' HB ' ' OG1' ' A' ' 77' ' ' THR . 1.7 p -72.27 113.7 9.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.129 0.49 . . . . 64.43 111.124 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.0 t -96.51 118.58 33.32 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.751 -0.659 . . . . 72.34 109.936 -178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.403 HG22 ' HB ' ' A' ' 77' ' ' THR . 20.2 p -81.23 109.92 16.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.416 177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.6 mt -123.56 122.3 37.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.496 -0.32 . . . . 71.14 110.169 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.63 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 9.7 p30 -91.72 128.52 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.309 0.576 . . . . 64.45 110.6 179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' A' ' 150' ' ' GLN . 67.8 mmtt -137.08 123.16 20.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.86 -0.609 . . . . 71.15 110.619 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 73' ' ' ASP . 6.6 p -83.57 126.37 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 121.363 0.602 . . . . 74.22 110.534 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.538 ' HB ' HD13 ' A' ' 146' ' ' LEU . 13.3 tt -118.91 139.49 46.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.497 -0.774 . . . . 62.12 109.867 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.416 ' HD1' ' HB2' ' A' ' 71' ' ' ALA . 52.5 t80 -102.4 111.76 24.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.416 -0.587 . . . . 73.43 109.416 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 34.5 t -103.94 111.42 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.156 -0.474 . . . . 52.43 110.386 -176.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.914 HE22 HG22 ' A' ' 114' ' ' VAL . 84.4 mt-30 -84.01 106.38 15.62 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.094 -0.503 . . . . 61.35 110.537 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HB2' ' O ' ' A' ' 68' ' ' ARG . 96.2 m-85 -86.52 109.71 19.29 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 75.32 110.424 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 46.9 t -175.39 124.81 0.35 Allowed Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.569 -0.741 . . . . 62.3 109.507 178.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.461 ' HA ' ' CB ' ' A' ' 132' ' ' SER . 31.2 Cg_endo -66.96 148.58 82.21 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.165 1.91 . . . . 75.22 111.845 177.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -72.29 -7.25 48.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.378 0.608 . . . . 71.44 110.76 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -92.73 12.3 23.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.934 -0.575 . . . . 73.31 110.601 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . . . -67.53 140.09 94.57 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.172 -0.467 . . . . 43.41 111.303 -177.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' ALA . 36.5 Cg_exo -58.15 159.31 19.05 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.847 2.365 . . . . 74.15 111.754 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 93.4 t -55.85 -36.47 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 71.3 112.199 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.656 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 2.3 mpt_? -65.99 -42.94 89.16 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.666 0.27 . . . . 72.44 110.891 -177.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -76.05 -34.68 59.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.294 -0.261 . . . . 70.23 110.294 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.563 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 14.2 tpp180 -57.29 -49.72 75.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 53.33 110.414 174.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 14.8 tpt -59.71 -39.42 84.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.639 -0.71 . . . . 53.44 111.225 -178.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 105' ' ' ARG . 92.7 mt -58.7 -64.04 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.302 -0.408 . . . . 75.23 112.097 -177.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 107' ' ' ARG . 21.2 p90 -68.23 -37.1 80.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.546 -0.462 . . . . 73.5 111.054 -172.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -71.06 -32.19 68.81 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.984 0.365 . . . . 62.05 111.984 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.863 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 62.4 m -88.52 -20.26 25.33 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.669 -0.413 . . . . 74.34 111.405 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 49.6 m -78.65 -16.51 57.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.596 -0.274 . . . . 62.15 110.853 178.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.914 HG22 HE22 ' A' ' 96' ' ' GLN . 66.5 t -50.97 -59.27 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.0 0.429 . . . . 72.33 111.7 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -20.45 66.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.003 -0.544 . . . . 52.4 111.437 -176.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.2 -59.53 2.44 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.685 0.254 . . . . 52.14 111.685 -176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 118' ' ' LYS . 4.2 pp -78.15 -33.75 50.18 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.059 0.392 . . . . 72.02 112.059 -171.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 117' ' ' LEU . 12.8 tmtt? -78.75 -39.22 36.75 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.818 0.342 . . . . 73.33 111.182 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -77.03 -38.74 52.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.741 0.305 . . . . 52.11 110.939 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.453 ' HB3' HG11 ' A' ' 7' ' ' VAL . 9.5 t -69.47 -25.34 64.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.419 -0.355 . . . . 73.21 111.183 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.5 -0.93 56.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.002 0.43 . . . . 63.24 110.892 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.86 35.72 49.55 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.788 -0.72 . . . . 62.51 112.985 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.798 ' HA ' HD23 ' A' ' 126' ' ' LEU . 10.5 mp -97.37 25.42 5.64 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.97 -0.381 . . . . 63.12 109.97 176.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.77 -44.8 96.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.122 -0.49 . . . . 65.12 111.147 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 48.5 m -90.25 16.69 8.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.822 0.344 . . . . 45.3 111.009 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.798 HD23 ' HA ' ' A' ' 123' ' ' LEU . 3.8 mm? -108.72 -169.38 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 62.11 110.566 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -119.02 136.26 54.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.844 0.354 . . . . 71.45 111.604 -169.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -128.09 120.51 27.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.062 -0.517 . . . . 74.1 109.949 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 97.5 t -125.36 128.65 72.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.356 -0.384 . . . . 65.41 110.122 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -86.12 150.77 24.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.777 0.322 . . . . 65.22 110.222 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 137' ' ' LEU . . . -141.32 129.0 21.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.224 -0.444 . . . . 54.31 109.969 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.461 ' CB ' ' HA ' ' A' ' 99' ' ' PRO . 51.0 m -89.76 -65.97 0.97 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.998 0.37 . . . . 70.24 111.998 -176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -121.1 -175.05 2.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.66 -0.416 . . . . 63.02 111.377 -178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.3 -35.89 78.57 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.203 0.816 . . . . 55.23 113.203 -169.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.459 ' O ' ' HE2' ' A' ' 140' ' ' LYS . 4.1 m -77.28 -24.24 51.04 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.402 0.62 . . . . 51.25 109.909 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -80.94 -22.35 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.231 -0.895 . . . . 71.14 110.404 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 4.5 pp -103.42 4.65 36.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.89 -0.595 . . . . 62.44 110.785 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.552 ' HB3' ' CD ' ' A' ' 140' ' ' LYS . 8.8 t70 -67.0 143.13 56.96 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.908 -0.587 . . . . 72.22 110.292 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 143' ' ' LYS . 0.7 OUTLIER -61.84 -22.95 65.94 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.47 0.544 . . . . 75.12 112.47 -170.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.552 ' CD ' ' HB3' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -56.32 -24.42 43.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.895 0.379 . . . . 72.01 111.017 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.8 m -105.65 -53.27 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.457 -0.338 . . . . 70.02 110.832 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.15 -47.35 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 120.848 0.356 . . . . 73.31 111.537 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 139' ' ' GLU . 2.4 tmmm? -63.81 -42.6 97.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.313 -0.403 . . . . 72.05 110.578 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.7 m -66.98 -40.21 87.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.326 -0.397 . . . . 63.21 111.122 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -65.18 -50.85 64.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.51 . . . . 74.31 110.499 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 93' ' ' ILE . 58.4 tp -58.35 -46.75 85.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.842 -0.617 . . . . 51.52 110.677 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.533 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 13.2 tmm? -59.25 -30.45 68.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.874 -0.603 . . . . 42.24 111.502 -178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 11.1 t -81.66 -31.68 32.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.345 -0.389 . . . . 74.14 111.054 -177.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -95.5 -1.88 49.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.492 0.552 . . . . 72.14 112.492 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.533 ' OE1' ' HA ' ' A' ' 147' ' ' MET . 23.9 mt-30 -46.09 -40.39 10.79 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.503 0.927 . . . . 70.24 113.503 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 151' ' ' ARG . 8.6 ptm180 -136.82 32.86 2.69 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.757 -0.377 . . . . 72.1 111.535 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.308 -0.853 . . . . 71.05 109.66 178.658 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.967 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 64.9 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.524 0.202 . . . . 72.45 110.643 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.35 23.87 0.47 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.739 0.644 . . . . 74.24 112.739 -173.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 115' ' ' ARG . 34.8 m 60.69 -157.46 0.34 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.553 -0.294 . . . . 75.05 110.787 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 117.04 -27.37 7.82 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 111.369 -0.693 . . . . 61.22 111.369 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.492 HG12 HG13 ' A' ' 38' ' ' ILE . 41.2 t -90.79 128.29 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.913 -0.403 . . . . 74.03 109.913 177.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.611 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -84.06 138.87 32.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.969 -0.56 . . . . 73.21 111.759 -173.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.7 m -86.05 115.06 26.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.212 -0.904 . . . . 53.25 110.039 174.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -90.57 133.66 32.33 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.103 -0.499 . . . . 60.44 111.063 -174.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.42 -30.65 93.2 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.295 2.663 . . . . 63.42 113.051 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -67.63 -33.95 75.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 44.42 110.571 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.479 ' HA ' ' CG2' ' A' ' 40' ' ' VAL . 47.3 t -70.5 -39.39 74.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.161 0.505 . . . . 70.52 109.89 177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -69.07 -35.62 76.72 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.815 -0.63 . . . . 61.12 110.691 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.408 HD22 ' C ' ' A' ' 13' ' ' ASN . 0.2 OUTLIER -61.78 -35.76 79.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.901 0.382 . . . . 74.21 110.087 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -38.42 54.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.323 -0.399 . . . . 54.52 110.976 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.678 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 74.7 t80 -70.72 -33.07 70.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.71 -0.677 . . . . 74.43 111.136 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -37.17 72.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.031 -0.531 . . . . 74.12 111.43 -175.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.688 ' O ' ' HB2' ' A' ' 21' ' ' LYS . 98.3 mt -74.44 -22.79 58.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.648 0.61 . . . . 55.1 112.648 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.6 pp -85.82 -21.72 27.98 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.791 -0.568 . . . . 74.21 111.833 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -61.61 -60.79 3.14 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.402 0.519 . . . . 73.23 112.402 -169.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -125.01 19.97 8.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.102 0.477 . . . . 71.13 111.259 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 68.2 mmtt -124.68 -42.02 2.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.033 -0.531 . . . . 50.42 109.928 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.42 ' HE1' ' HA ' ' A' ' 74' ' ' VAL . 68.3 t60 72.36 27.92 2.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.442 -1.254 . . . . 65.52 109.078 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -72.85 -15.85 61.6 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.456 0.646 . . . . 70.43 109.453 177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 18' ' ' LEU . 37.7 m170 -126.47 138.29 53.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.41 -0.814 . . . . 74.05 108.906 174.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' A' ' 48' ' ' ALA . 23.0 t -85.83 -52.79 5.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.753 -0.379 . . . . 74.12 110.439 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HE1' ' HB1' ' A' ' 48' ' ' ALA . 41.7 p90 -136.47 155.93 49.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.3 110.939 -178.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.7 tt -141.88 133.02 26.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.862 -0.608 . . . . 61.33 110.071 171.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.1 mt -114.71 118.58 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.613 -0.721 . . . . 75.04 109.192 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.49 ' HE1' HD22 ' A' ' 117' ' ' LEU . 21.1 p90 -115.22 157.0 24.33 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.172 0.51 . . . . 74.31 111.311 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -143.65 161.85 37.48 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.179 -0.919 . . . . 74.31 110.287 -173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.449 ' HA ' ' O ' ' A' ' 37' ' ' ALA . 71.5 mt -86.78 101.98 11.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.984 -0.747 . . . . 75.55 108.984 172.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 38.0 t70 -140.38 90.87 2.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.113 0.783 . . . . 72.34 113.113 -170.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 18.7 ptpt 167.59 166.86 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 74.32 108.563 169.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.71 -48.97 66.27 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.358 0.411 . . . . 53.5 111.407 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.525 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 37.2 t70 -94.53 116.79 29.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.437 -0.949 . . . . 72.05 108.437 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.463 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 15.9 p -47.83 109.71 0.25 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.25 0.833 . . . . 74.14 113.25 -169.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . . . -143.22 154.06 43.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.611 . . . . 44.1 110.886 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 117' ' ' LEU . 75.3 mt -88.75 123.13 40.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.588 -0.733 . . . . 73.43 110.935 -178.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.531 ' CG1' ' HB3' ' A' ' 32' ' ' ASP . 8.8 p -133.06 163.14 38.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.76 -0.459 . . . . 74.35 109.76 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 11' ' ' CYS . 47.4 t -78.8 132.93 31.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.942 0.401 . . . . 75.13 111.523 -176.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 11.5 tp10 -104.18 -48.15 3.95 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.453 -0.573 . . . . 73.43 109.453 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 41' ' ' GLU . 5.7 mptp? -133.79 139.56 46.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.604 -0.725 . . . . 64.23 109.971 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.7 p -145.61 118.32 2.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 108.998 -0.741 . . . . 72.01 108.998 172.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.83 147.14 18.51 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.501 -0.857 . . . . 40.13 112.452 -174.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -68.88 -179.11 1.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.732 0.313 . . . . 62.54 110.651 177.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -49.4 -56.46 9.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 71.23 111.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -87.76 80.17 7.97 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.963 0.411 . . . . 64.03 110.804 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 25' ' ' SER . . . -123.93 91.17 49.95 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.812 -0.631 . . . . 42.12 110.186 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.36 150.02 84.65 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.27 2.646 . . . . 64.44 112.589 -177.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.636 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 47.8 p90 -65.33 -27.47 68.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.038 -0.528 . . . . 73.1 111.521 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.87 -42.25 89.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.022 0.439 . . . . 75.41 110.837 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.78 -34.29 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.521 . . . . 74.31 110.225 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 27.0 t80 -54.84 -48.09 73.3 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.85 -0.613 . . . . 70.3 111.026 175.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 50' ' ' TYR . 72.0 t -58.82 -43.16 87.55 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 CA-C-N 116.187 -0.46 . . . . 64.4 111.337 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 58' ' ' LYS . 29.1 mt-10 -78.75 -28.96 44.91 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.088 0.403 . . . . 75.41 112.088 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.704 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 50.5 mm-40 -61.71 -32.48 72.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.42 0.629 . . . . 65.32 109.678 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.58 ' O ' HG23 ' A' ' 61' ' ' VAL . 44.7 ttp -85.9 -32.77 21.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.151 -0.931 . . . . 52.21 110.671 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.57 ' HB3' ' HA ' ' A' ' 55' ' ' GLU . 21.2 ttmt -54.26 -52.43 61.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.935 -0.575 . . . . 42.03 112.239 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 50.7 pttt -59.94 -20.14 55.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.284 0.564 . . . . 73.23 111.366 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 60.6 tp -84.73 -37.0 21.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.816 -0.629 . . . . 72.43 110.032 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 57' ' ' MET . 43.0 t -75.21 -31.34 24.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 63.14 111.199 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 59' ' ' LYS . 9.5 pt-20 -71.63 -19.54 62.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.73 0.3 . . . . 63.42 110.742 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.84 1.83 52.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.01 111.438 -177.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.0 173.54 20.44 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.468 -0.872 . . . . 52.51 112.418 176.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -77.07 74.62 3.64 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.785 -0.45 . . . . 64.54 109.785 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -99.5 132.96 44.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 74.51 110.52 -175.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.451 ' H ' ' NH1' ' A' ' 106' ' ' ARG . 29.0 p -109.88 137.69 47.31 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.735 -0.469 . . . . 50.15 109.735 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.548 ' N ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -146.38 148.12 32.01 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.273 -0.421 . . . . 74.31 110.242 -173.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -101.41 129.84 47.52 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.405 -0.361 . . . . 60.3 110.055 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -124.03 137.35 54.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.041 0.448 . . . . 64.54 111.329 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -121.07 127.96 52.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.656 -0.702 . . . . 71.53 109.344 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 92' ' ' VAL . 7.0 p -131.75 128.67 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.069 0.461 . . . . 72.3 111.427 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.861 ' HB2' ' HB ' ' A' ' 92' ' ' VAL . 22.1 t70 -108.46 122.89 47.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 73.34 109.735 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' ASN . 15.2 m -139.32 144.97 27.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 116.242 -0.436 . . . . 43.21 110.391 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 0.9 OUTLIER -86.9 106.53 17.83 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.414 -0.588 . . . . 71.31 109.414 173.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.8 t -89.11 138.11 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.755 -0.657 . . . . 72.41 110.733 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.4 p -85.63 101.49 12.77 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.783 -0.644 . . . . 71.24 111.031 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.632 HG12 ' H ' ' A' ' 79' ' ' GLN . 2.4 t -118.48 179.05 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 43.34 109.923 -177.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.632 ' H ' HG12 ' A' ' 78' ' ' VAL . 36.1 tt0 -143.15 106.35 4.56 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.4 -0.592 . . . . 64.45 109.4 175.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.791 HH22 ' HA ' ' A' ' 148' ' ' SER . 70.5 mtt180 -145.66 -63.78 0.33 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.373 0.509 . . . . 75.33 112.373 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -66.54 163.97 17.56 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.803 -0.635 . . . . 65.03 111.82 -172.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.51 52.88 0.47 Allowed Glycine 0 C--N 1.337 0.592 0 O-C-N 123.803 0.689 . . . . 75.32 113.595 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.68 71.38 1.35 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.065 -1.457 . . . . 73.02 107.065 171.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -54.42 126.19 22.42 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.72 -1.127 . . . . 72.44 112.264 -168.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 149.41 -108.28 0.39 Allowed Glycine 0 N--CA 1.441 -1.019 0 CA-C-N 114.42 -1.263 . . . . 61.11 110.382 -174.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.8 m -139.07 114.85 10.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.559 0.695 . . . . 75.22 111.19 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.9 m -87.79 105.3 17.3 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.029 -0.987 . . . . 65.41 109.75 176.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.8 p -92.61 109.74 21.15 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.395 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HB2' ' NE2' ' A' ' 150' ' ' GLN . 75.3 mt -122.97 125.99 46.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.225 -0.443 . . . . 75.35 110.244 -177.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.519 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 2.1 p-10 -84.28 134.39 34.52 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.344 -0.613 . . . . 74.23 109.344 176.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.745 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 48.7 mmtt -143.89 110.44 5.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.13 -0.486 . . . . 75.41 110.566 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.861 ' HB ' ' HB2' ' A' ' 73' ' ' ASP . 3.2 p -78.06 103.67 5.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.844 0.83 . . . . 74.03 110.26 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.483 HD12 ' HB3' ' A' ' 146' ' ' LEU . 11.1 tt -92.53 138.88 19.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.274 -0.876 . . . . 63.21 109.832 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -102.56 113.02 26.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.968 -0.56 . . . . 61.35 110.013 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.26 109.87 29.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.723 -0.672 . . . . 60.42 110.583 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -84.17 112.72 20.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.801 -0.636 . . . . 74.23 109.632 175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.539 ' CE2' ' HG3' ' A' ' 99' ' ' PRO . 85.7 t80 -86.84 92.69 9.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.17 0.509 . . . . 75.12 109.688 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 25.5 m -118.88 93.01 45.91 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.403 -0.817 . . . . 72.2 109.919 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.539 ' HG3' ' CE2' ' A' ' 97' ' ' TYR . 1.0 OUTLIER -83.95 144.13 10.72 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.881 2.387 . . . . 64.32 112.212 -178.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.98 -14.18 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.259 0.552 . . . . 74.11 109.927 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -89.39 9.31 26.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.389 -0.823 . . . . 74.11 110.817 -178.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.4 138.86 22.29 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.488 -0.323 . . . . 71.34 110.778 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.516 ' HD2' ' HD2' ' A' ' 106' ' ' ARG . 18.4 Cg_endo -60.29 156.23 41.8 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.977 2.452 . . . . 64.43 112.666 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 50.9 t -61.21 -53.03 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.712 -0.676 . . . . 75.35 112.665 -172.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -44.75 90.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.951 0.405 . . . . 74.14 110.633 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.516 ' HD2' ' HD2' ' A' ' 103' ' ' PRO . 42.7 ttm-85 -55.41 -52.3 64.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.545 -0.752 . . . . 73.3 111.797 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -72.05 -25.33 61.74 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.607 -0.437 . . . . 62.33 110.879 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.5 tpt -64.14 -41.07 97.33 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.353 -0.385 . . . . 73.22 110.833 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.23 -53.4 58.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.838 -0.619 . . . . 54.13 110.883 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -68.04 -37.45 81.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 65.14 111.492 -177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.49 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.133 0.492 . . . . 71.13 111.328 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.967 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 74.2 m -86.02 -15.01 42.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.437 -0.347 . . . . 74.12 111.125 178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.591 ' O ' ' HG ' ' A' ' 117' ' ' LEU . 22.7 t -83.0 -18.77 38.68 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.234 -0.439 . . . . 50.23 110.489 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 77.8 t -53.59 -42.16 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.005 -0.543 . . . . 35.23 111.806 -178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HD2' ' OG ' ' A' ' 3' ' ' SER . 4.2 tmt_? -57.09 -37.32 71.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 71.53 110.971 -178.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.84 -56.31 3.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.221 -0.445 . . . . 74.21 111.836 -176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 113' ' ' SER . 2.8 pp -66.74 -26.59 67.06 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.057 0.762 . . . . 52.55 113.057 -169.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.827 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.0 tmtt? -80.58 -48.89 12.04 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.512 -0.475 . . . . 64.25 110.813 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.68 -41.44 31.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.907 0.336 . . . . 73.54 111.907 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.2 t -73.77 -21.7 60.1 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.03 0.381 . . . . 51.34 112.03 -172.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.83 -11.15 40.23 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.55 -0.46 . . . . 73.44 111.087 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.3 51.51 3.3 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.496 -0.859 . . . . 74.34 112.316 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.827 HD12 ' HA ' ' A' ' 118' ' ' LYS . 81.4 mt -102.55 21.25 15.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.372 0.606 . . . . 55.44 109.583 175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -71.15 -42.99 68.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.361 -0.836 . . . . 73.24 110.432 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 53.0 m -94.57 16.08 16.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.721 -0.672 . . . . 73.51 110.421 177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' HG13 ' A' ' 92' ' ' VAL . 3.3 mm? -119.27 -176.12 3.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.678 -0.692 . . . . 64.43 109.823 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -128.01 143.53 51.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.975 0.417 . . . . 72.22 111.092 -174.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 15.3 tm0? -122.68 134.21 54.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.681 -0.69 . . . . 72.54 110.55 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.7 t -124.77 140.38 48.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.861 -0.609 . . . . 64.11 109.375 175.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -107.91 112.26 24.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.167 0.508 . . . . 74.1 110.553 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -103.86 153.97 20.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.892 -0.594 . . . . 71.31 109.949 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 26.8 m -90.87 -77.34 0.41 Allowed 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.884 -0.326 . . . . 73.11 111.817 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -168.25 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.944 -0.302 . . . . 64.44 111.673 -173.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -66.2 -29.59 69.88 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.301 0.852 . . . . 72.34 113.301 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.2 t -76.35 -46.39 27.7 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.62 -0.432 . . . . 64.14 110.363 -176.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -67.63 -18.19 64.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 71.43 110.82 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.543 ' O ' HD13 ' A' ' 137' ' ' LEU . 2.7 tm? -78.78 -20.95 48.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.655 -0.702 . . . . 75.43 110.726 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -60.53 145.51 48.33 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.235 0.54 . . . . 71.35 111.775 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 143' ' ' LYS . 15.1 pt-20 -50.83 -23.26 2.65 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.023 -0.989 . . . . 75.21 112.876 -177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.25 -35.56 5.34 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.616 0.228 . . . . 73.4 111.616 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.9 m -101.2 -53.55 2.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.555 0.217 . . . . 64.4 110.71 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.662 HG12 HD23 ' A' ' 146' ' ' LEU . 48.8 t -56.63 -54.61 26.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 71.11 111.926 -174.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 139' ' ' GLU . 4.1 tmmm? -60.99 -42.69 98.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.336 -0.393 . . . . 53.1 110.896 -177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 10.4 m -70.49 -32.38 69.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.189 -0.46 . . . . 75.54 111.187 -177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.01 -47.58 13.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.203 -0.453 . . . . 72.43 111.069 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.662 HD23 HG12 ' A' ' 142' ' ' VAL . 4.5 pp -62.63 -29.61 70.75 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.831 -0.168 . . . . 72.24 111.102 -176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.453 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 16.6 tmm? -58.86 -36.82 75.23 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.253 0.549 . . . . 54.22 110.102 177.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . 0.791 ' HA ' HH22 ' A' ' 80' ' ' ARG . 20.3 t -80.1 -37.65 33.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.832 -0.622 . . . . 73.23 110.032 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.15 -21.37 65.82 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.879 -0.6 . . . . 73.44 111.695 -176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HG2' ' HG3' ' A' ' 91' ' ' LYS . 29.4 mt-30 -43.27 -53.4 5.21 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 123.377 0.423 . . . . 73.45 111.808 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -161.1 105.37 1.33 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.461 0.648 . . . . 72.31 109.357 173.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.244 0.785 0 CA-C-O 118.139 -0.934 . . . . 54.41 110.514 -177.111 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 1.101 ' HA ' ' HA ' ' A' ' 112' ' ' SER . 47.2 ttm . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 121.162 0.506 . . . . 62.24 110.02 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 87.44 4.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 64.24 111.562 -174.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 112' ' ' SER . 24.0 t -174.3 153.13 1.91 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.008 -0.542 . . . . 51.22 109.912 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.57 52.19 1.78 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.069 -0.586 . . . . 41.23 111.74 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.9 t -61.76 109.91 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.148 0.499 . . . . 63.41 110.613 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 37' ' ' ALA . 17.6 ptmt -88.37 155.33 19.76 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.711 -0.677 . . . . 74.34 110.102 178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 120' ' ' SER . 26.8 m -97.91 143.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.46 -0.57 . . . . 63.13 109.46 171.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.92 119.75 69.37 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 108.707 -0.849 . . . . 71.11 108.707 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_exo -44.01 -28.08 2.04 Favored 'Trans proline' 0 N--CA 1.479 0.638 0 C-N-CA 124.253 3.302 . . . . 62.01 114.725 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.9 m -57.28 -26.79 61.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.832 0.308 . . . . 70.04 111.832 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.537 ' HA ' HG23 ' A' ' 40' ' ' VAL . 29.5 p -79.06 -44.49 22.05 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.88 0.372 . . . . 63.13 110.783 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -66.22 -39.37 89.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.975 -0.557 . . . . 64.45 110.606 -178.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -55.45 -38.84 69.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 70.32 111.169 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -85.77 -29.63 23.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.219 -0.446 . . . . 43.32 111.103 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.542 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 85.4 t80 -62.12 -38.68 89.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.725 -0.67 . . . . 64.02 111.64 -177.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.47 -29.5 69.08 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.73 0.27 . . . . 73.2 111.73 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 82.3 mt -64.23 -37.76 88.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.363 -0.38 . . . . 74.12 111.234 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 15' ' ' TYR . 4.0 pp -85.71 -34.63 21.2 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.755 -0.378 . . . . 74.35 111.277 176.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.477 ' HD2' HG21 ' A' ' 92' ' ' VAL . 17.0 t-160 -49.12 -46.67 45.27 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.568 0.951 . . . . 73.4 113.568 -168.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -149.0 18.3 0.98 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.754 0.788 . . . . 75.4 110.335 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.63 ' HB3' ' O ' ' A' ' 17' ' ' LEU . 1.2 tpmt? -120.93 -23.7 5.82 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.556 -0.747 . . . . 71.14 109.732 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.436 ' HD2' ' OD2' ' A' ' 73' ' ' ASP . 15.8 t-80 58.01 29.87 18.37 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.338 -0.846 . . . . 75.23 111.426 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.527 ' HG3' ' CG ' ' A' ' 21' ' ' LYS . 39.0 mt-30 -73.1 -17.79 61.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 72.53 110.405 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -138.81 170.91 15.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.435 -1.32 . . . . 62.32 107.435 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 46' ' ' LYS . 29.2 t -113.31 -69.49 0.86 Allowed 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.142 -0.623 . . . . 73.14 111.246 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CZ ' ' HA3' ' A' ' 44' ' ' GLY . 51.4 p90 -111.09 145.75 38.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 75.34 110.762 -177.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.5 tt -142.51 134.15 25.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.487 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.28 129.92 46.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.262 -0.427 . . . . 75.12 110.456 -178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' HB2' ' A' ' 11' ' ' CYS . 79.2 m-85 -114.11 151.89 31.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.091 -0.504 . . . . 71.05 110.184 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.707 ' HG3' ' HB2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -142.03 155.98 45.42 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.259 -0.428 . . . . 63.15 110.08 173.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.74 HD13 ' HB3' ' A' ' 109' ' ' LEU . 12.5 tt -85.71 101.51 10.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.951 0.881 . . . . 75.34 109.537 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.446 ' HB2' ' CD ' ' A' ' 30' ' ' LYS . 4.8 t70 -113.33 -158.13 0.64 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.681 -1.145 . . . . 72.34 108.45 -175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.709 ' HG3' ' H ' ' A' ' 35' ' ' ASP . 12.2 tppt? 75.64 132.9 0.05 Allowed 'General case' 0 C--N 1.332 -0.166 0 O-C-N 123.725 0.641 . . . . 72.32 111.451 171.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -74.74 1.61 11.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.357 0.599 . . . . 74.44 110.221 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.709 ' H ' ' HG3' ' A' ' 33' ' ' LYS . 28.9 t70 -119.22 19.25 12.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.234 -0.894 . . . . 71.15 108.73 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.2 p 51.96 91.75 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.712 -1.131 . . . . 65.2 112.957 -178.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.664 ' HA ' ' O ' ' A' ' 6' ' ' LYS . . . -145.68 132.16 19.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.141 -0.481 . . . . 53.3 111.084 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.456 HD11 ' HB2' ' A' ' 113' ' ' SER . 69.1 mt -78.68 127.35 38.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.812 -0.631 . . . . 63.13 109.905 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -144.99 163.79 12.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.556 -0.293 . . . . 65.21 110.644 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 11' ' ' CYS . 50.0 t -62.14 135.84 26.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.062 -0.517 . . . . 74.44 111.701 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.707 ' HB2' ' HG3' ' A' ' 30' ' ' LYS . 7.2 tp10 -105.97 -46.51 4.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.512 -0.551 . . . . 74.15 109.512 172.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -149.59 132.27 15.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 70.11 110.232 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.48 124.46 73.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.239 0.543 . . . . 71.43 110.703 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.4 ' HA3' ' CZ ' ' A' ' 26' ' ' TYR . . . -95.15 161.02 23.21 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.979 -0.629 . . . . 74.11 111.807 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -81.71 162.73 22.87 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.063 0.459 . . . . 71.01 111.564 -176.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 25' ' ' SER . 13.1 pttm -66.6 -28.98 68.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.545 -0.752 . . . . 74.34 111.537 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 49' ' ' PRO . 8.9 m120 -102.12 13.26 35.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.185 -0.461 . . . . 73.45 111.013 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . . . -97.33 104.28 19.3 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 63.12 109.876 177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 48' ' ' ALA . 2.7 Cg_exo -76.73 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.189 2.593 . . . . 72.23 112.585 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 53' ' ' PHE . 48.8 p90 -68.4 -20.53 64.68 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.582 0.586 . . . . 63.54 112.582 -171.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.1 -49.65 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.09 0.471 . . . . 53.23 111.153 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -82.31 -21.58 36.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 74.01 110.834 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 50' ' ' TYR . 64.5 t80 -61.87 -40.11 94.24 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.61 -0.515 . . . . 65.1 109.61 171.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' TYR . 85.0 t -59.23 -48.33 87.3 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 CA-C-N 116.009 -0.541 . . . . 65.12 110.005 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -52.03 -47.29 65.09 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.33 0.394 . . . . 73.42 111.735 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 1.016 ' HA ' ' HE2' ' A' ' 59' ' ' LYS . 5.8 mm-40 -68.65 -30.48 69.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.238 -0.437 . . . . 55.14 111.003 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.529 ' O ' HG23 ' A' ' 61' ' ' VAL . 46.0 tpp -86.48 -48.59 8.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.849 0.685 . . . . 70.05 112.849 -174.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.47 -26.01 68.53 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.467 0.543 . . . . 73.04 112.467 -171.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 1.016 ' HE2' ' HA ' ' A' ' 56' ' ' GLU . 52.6 pttt -72.57 -20.68 61.27 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.143 0.497 . . . . 72.14 110.623 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.0 mt -85.63 -42.4 14.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.566 . . . . 75.24 110.326 174.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.899 HG22 HH21 ' A' ' 68' ' ' ARG . 17.2 t -66.69 -20.41 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-N 115.884 -0.598 . . . . 54.52 112.112 -173.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -64.11 -14.12 52.59 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.252 -0.28 . . . . 70.42 111.545 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.32 -31.11 57.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.736 0.303 . . . . 70.51 110.351 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.37 -30.07 3.45 Favored Glycine 0 C--N 1.329 0.189 0 CA-C-N 116.175 -0.466 . . . . 73.32 113.275 173.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.559 ' HB2' ' HD3' ' A' ' 103' ' ' PRO . 33.3 pttt -118.33 19.26 13.49 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.965 0.412 . . . . 72.42 110.889 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.44 170.63 14.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.294 0.568 . . . . 71.54 111.23 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.0 t -150.09 132.06 15.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.391 -0.596 . . . . 74.14 109.391 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.899 HH21 HG22 ' A' ' 61' ' ' VAL . 0.0 OUTLIER -160.39 149.46 17.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.048 0.452 . . . . 75.51 111.21 -176.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' HB3' ' CZ ' ' A' ' 94' ' ' PHE . 24.9 m-85 -104.5 152.21 22.64 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.659 -0.7 . . . . 74.54 109.559 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -138.71 134.1 33.13 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.874 0.369 . . . . 45.21 111.251 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' HB2' ' HD1' ' A' ' 94' ' ' PHE . . . -124.63 134.63 52.84 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.857 -0.611 . . . . 53.5 109.486 175.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.7 p -144.17 130.8 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.891 0.376 . . . . 52.4 111.562 -177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.583 ' HB2' HG22 ' A' ' 92' ' ' VAL . 30.3 t70 -95.58 114.49 26.25 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.129 -0.693 . . . . 60.33 109.129 172.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.23 130.18 65.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.97 -0.559 . . . . 74.33 110.742 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.762 ' HA ' ' HA ' ' A' ' 90' ' ' ASN . 1.3 pm0 -87.26 106.64 18.05 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.475 0.655 . . . . 51.5 109.921 175.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.42 HG11 ' HG3' ' A' ' 147' ' ' MET . 67.9 t -90.69 115.2 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.822 -0.626 . . . . 55.23 109.846 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.1 t -87.12 117.81 26.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.721 0.772 . . . . 73.14 110.313 178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.05 -174.13 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.965 -1.016 . . . . 72.52 110.178 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.486 ' O ' ' HD2' ' A' ' 80' ' ' ARG . 56.6 tt0 -113.46 106.14 14.2 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.369 -0.604 . . . . 65.25 109.369 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.486 ' HD2' ' O ' ' A' ' 79' ' ' GLN . 31.2 mmm180 -137.1 -168.95 2.38 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.266 -0.642 . . . . 75.03 109.266 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.2 161.83 21.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.099 0.476 . . . . 72.11 111.309 176.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.43 -49.07 1.88 Allowed Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.837 -0.905 . . . . 73.54 110.837 -176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.68 107.01 3.89 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.121 -0.696 . . . . 21.2 109.121 173.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -73.48 42.93 0.13 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.286 0.565 . . . . 73.14 112.15 -175.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -156.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.804 -0.918 . . . . 55.14 110.804 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 4.5 p -135.05 103.75 5.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.203 0.525 . . . . 74.43 111.685 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 t -116.55 104.98 11.96 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 64.33 108.783 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 75' ' ' GLU . 19.9 m -110.11 111.0 22.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.323 -0.399 . . . . 71.13 111.051 -174.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.3 mp -117.47 126.91 53.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.193 -0.458 . . . . 72.25 110.081 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 3.8 p-10 -88.25 131.98 34.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.46 -0.57 . . . . 70.32 109.46 176.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.597 ' HG3' ' HG2' ' A' ' 150' ' ' GLN . 70.1 mmtt -136.98 142.81 42.57 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.774 -0.648 . . . . 75.44 110.666 -176.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.583 HG22 ' HB2' ' A' ' 73' ' ' ASP . 22.4 t -104.09 100.26 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 50.54 110.444 -176.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.641 ' HB ' HD13 ' A' ' 126' ' ' LEU . 8.8 tt -94.94 145.55 7.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.365 -0.38 . . . . 61.42 110.218 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.637 ' CZ ' ' HB3' ' A' ' 69' ' ' TYR . 38.0 t80 -112.57 114.82 27.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.905 -0.589 . . . . 73.55 109.75 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.676 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 16.9 t -110.24 107.94 24.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.022 0.439 . . . . 62.04 110.911 -177.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -85.04 112.01 20.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.07 -0.513 . . . . 65.45 110.51 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.604 ' HB2' ' HD2' ' A' ' 68' ' ' ARG . 82.4 m-85 -96.16 116.73 29.44 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 110.125 -0.324 . . . . 62.25 110.125 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 50.9 t -164.39 111.85 0.9 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.483 -0.326 . . . . 74.31 110.953 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.46 166.02 29.85 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.305 2.003 . . . . 72.1 111.512 174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.61 -28.64 58.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.944 0.402 . . . . 62.53 110.918 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -83.11 10.86 7.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 73.51 111.984 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.83 146.44 97.46 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.366 -0.379 . . . . 74.02 110.298 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 65' ' ' LYS . 76.2 Cg_exo -50.2 132.09 32.82 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.957 2.438 . . . . 71.01 112.374 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -53.8 -36.57 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 115.868 -0.606 . . . . 74.51 112.547 -174.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.812 ' H ' ' HD2' ' A' ' 105' ' ' ARG . 0.3 OUTLIER -63.0 -46.82 85.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 73.22 110.097 -178.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -72.71 -31.67 65.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.861 -0.609 . . . . 72.42 110.073 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -62.91 -41.57 99.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.4 -0.818 . . . . 74.24 110.034 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.8 tpp -64.98 -41.74 95.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.64 -0.709 . . . . 72.23 110.612 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.74 ' HB3' HD13 ' A' ' 31' ' ' ILE . 97.5 mt -61.51 -45.73 92.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 71.11 110.251 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -53.86 -42.23 68.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.26 -0.882 . . . . 73.33 111.533 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -77.99 -19.71 53.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.282 -0.417 . . . . 34.02 111.758 -177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 1.101 ' HA ' ' HA ' ' A' ' 1' ' ' MET . 51.1 m -88.99 -34.0 16.99 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.12 0.415 . . . . 65.23 112.12 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD11 ' A' ' 38' ' ' ILE . 16.9 p -75.72 -11.47 60.0 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.057 0.391 . . . . 72.12 112.057 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 49.0 t -45.77 -64.53 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 113.259 0.837 . . . . 71.22 113.259 -171.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.537 HH11 ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.42 -20.28 61.45 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.557 -0.457 . . . . 73.14 111.473 -175.051 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.537 ' HB2' HH11 ' A' ' 115' ' ' ARG . . . -76.17 -48.16 21.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.334 -0.394 . . . . 64.33 111.198 -176.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 118' ' ' LYS . 2.9 pp -65.65 -34.19 77.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.255 0.465 . . . . 62.33 112.255 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.748 ' HA ' HD12 ' A' ' 123' ' ' LEU . 11.6 mtpt -70.25 -53.11 18.34 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.669 -0.413 . . . . 70.5 111.572 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -68.04 -39.12 83.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.262 -0.427 . . . . 71.03 111.966 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.402 ' HB3' HG21 ' A' ' 7' ' ' VAL . 18.8 m -70.55 -26.6 63.62 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.229 0.455 . . . . 71.34 112.229 -174.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.9 mp -101.2 -29.11 12.28 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.777 -0.369 . . . . 60.54 111.59 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 91.54 46.32 3.78 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.454 -0.879 . . . . 73.42 111.137 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.748 HD12 ' HA ' ' A' ' 118' ' ' LYS . 51.4 mt -87.14 20.97 2.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.819 0.342 . . . . 64.53 111.13 -176.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -79.4 -7.25 58.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.711 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 16.3 m -58.45 -28.05 64.93 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.983 -0.553 . . . . 63.14 110.952 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 150' ' ' GLN . 3.4 mt -146.11 -166.66 2.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.917 -0.583 . . . . 44.25 110.413 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -103.81 148.73 25.77 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.497 -0.774 . . . . 43.34 109.987 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.437 HE21 ' HB3' ' A' ' 128' ' ' GLN . 0.9 OUTLIER -80.23 124.16 28.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.988 0.423 . . . . 62.5 110.444 176.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.676 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 64.9 t -122.02 135.89 60.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.961 -0.755 . . . . 62.4 108.961 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -117.08 151.68 36.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.195 0.521 . . . . 74.31 111.354 -177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -138.94 152.13 47.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.291 -0.868 . . . . 63.43 109.867 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 29.1 m -84.88 -80.47 0.21 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.51 -0.313 . . . . 60.11 111.482 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.62 -168.79 1.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.048 0.388 . . . . 71.4 112.048 -175.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.572 ' HB3' HG11 ' A' ' 61' ' ' VAL . 26.6 ptt? -59.65 -30.08 68.49 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.26 0.837 . . . . 54.23 113.26 -170.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.4 m -83.64 -24.32 31.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.026 0.441 . . . . 62.13 111.053 -177.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -84.64 -30.81 24.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.912 -0.586 . . . . 74.5 111.29 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.9 pp -79.25 6.46 9.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.328 -0.396 . . . . 73.04 111.778 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.458 ' HB3' ' HG3' ' A' ' 140' ' ' LYS . 11.3 t70 -63.9 143.2 58.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.032 0.444 . . . . 73.25 110.305 179.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.407 ' HB2' ' CB ' ' A' ' 143' ' ' LYS . 16.2 pt-20 -56.73 -22.05 32.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.635 -0.712 . . . . 64.41 112.241 -176.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.584 ' HD2' ' N ' ' A' ' 141' ' ' SER . 0.0 OUTLIER -43.73 -35.28 1.79 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.95 0.722 . . . . 54.54 112.95 -179.019 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 140' ' ' LYS . 59.6 m -108.41 -50.44 3.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.619 0.247 . . . . 71.31 110.642 175.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 40.1 t -55.91 -58.07 6.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.021 -0.536 . . . . 61.23 111.769 -174.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 143' ' ' LYS . 4.8 tmmm? -63.76 -42.59 97.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.621 -175.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 6.8 m -64.52 -39.96 94.75 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.054 -0.521 . . . . 61.23 111.359 -177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.56 -43.35 20.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.262 -0.426 . . . . 75.33 111.564 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 4.2 pp -61.91 -30.19 70.72 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.731 0.3 . . . . 72.35 110.775 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.506 ' HA ' ' OE1' ' A' ' 150' ' ' GLN . 49.0 ttm -59.7 -36.73 77.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.822 -0.627 . . . . 70.31 111.114 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . 0.457 ' O ' ' HB ' ' A' ' 152' ' ' ILE . 44.3 t -80.43 -41.44 24.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.078 -0.51 . . . . 63.13 110.018 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -70.66 -4.89 25.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.123 -0.489 . . . . 61.42 112.179 -173.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.745 ' HA ' HD21 ' A' ' 126' ' ' LEU . 23.3 mt-30 -52.6 -37.94 59.13 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.105 0.409 . . . . 52.1 112.105 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -151.59 9.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.915 0.388 . . . . 73.22 110.836 175.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.457 ' HB ' ' O ' ' A' ' 148' ' ' SER . 83.9 mt . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.52 -0.752 . . . . 75.25 110.011 -179.201 . . . . . . . . 1 1 . 1 stop_ save_